165.0758211 |
Dulcitol |
C6H14O6 |
2.029510943 |
0.785977181 |
0.04619 |
182.0813976 |
L-Tyrosine |
C9H11NO3 |
1.43072621 |
0.909182644 |
0.0347 |
247.1081591 |
N-Acetyl-DL-tryptophan |
C13H14N2O3 |
3.477923069 |
0.409230769 |
0.006273 |
446.1641876 |
Neolinustatin |
C17H29NO11 |
2.188140041 |
0.655991165 |
0.03146 |
181.0862142 |
Cinnamic acid |
C9H8O2 |
1.044166887 |
0.93879056 |
0.007683 |
260.092448 |
4-Hydroxy-6-methyl-3-(1-oxobutyl)-2H-pyran-2-one |
C10H12O4 |
1.512029004 |
0.842019984 |
0.02607 |
334.1406239 |
Hypoglycin B |
C12H18N2O5 |
2.233698828 |
0.662004662 |
0.0272 |
191.1433524 |
4-(2,6,6-Trimethylcyclohexa-1,3-dienyl)but-3-en-2-one |
C13H18O |
2.039552122 |
0.754730713 |
0.01482 |
178.0865478 |
2'-Hydroxyacetophenone |
C8H8O2 |
1.891102159 |
0.734065345 |
0.04353 |
130.0653821 |
Isoquinoline |
C9H7N |
2.71673368 |
0.741964127 |
0.0007863 |
287.0556033 |
Elenaic acid |
C11H14O6 |
2.436665482 |
0.693766295 |
0.003888 |
302.1006546 |
Citrusinine I |
C16H15NO5 |
2.238737254 |
0.72616408 |
0.0007893 |
176.0710376 |
3-Methoxytyrosine |
C10H13NO4 |
1.234342591 |
0.912790698 |
0.02443 |
102.0553861 |
L-Threonine |
C4H9NO3 |
1.294403772 |
0.921037998 |
0.02015 |
145.1700286 |
DL-Coniine |
C8H17N |
2.949032467 |
0.693620046 |
0.0008137 |
281.08029 |
Gamma-Glutamyl-S-methylcysteine sulfoxide |
C9H16N2O6S |
2.979431423 |
0.649488671 |
0.0007583 |
138.0550266 |
Trigonelline |
C7H7NO2 |
1.492143073 |
0.910183428 |
0.02525 |
228.0980944 |
Asparaginyl-Hydroxyproline |
C9H15N3O5 |
2.650068037 |
0.692497431 |
0.003499 |
325.1431368 |
7-Aminoflunitrazepam |
C16H14FN3O |
1.715185011 |
0.849871262 |
0.02426 |
168.065635 |
3alpha,4,5,7alpha-Tetrahydro-5-hydroxy-1H-isoindole-1,3(2H)-dione |
C8H9NO3 |
1.21479967 |
0.923331952 |
0.02111 |
229.1187425 |
Prolylhydroxyproline |
C10H16N2O4 |
1.584290885 |
0.864428389 |
0.02776 |
156.0769882 |
L-Histidine |
C6H9N3O2 |
2.449054065 |
0.687629938 |
0.001114 |
203.139441 |
ALANYL-dl-LEUCINE |
C9H18N2O3 |
1.898923585 |
0.730629371 |
0.03388 |
324.1086528 |
L-DOPA 3'-glucoside |
C15H21NO9 |
1.552643218 |
0.881612091 |
0.003824 |
291.0392706 |
N5-(3,4-Dioxo-1,5-cyclohexadien-1-yl)-L-glutamine |
C11H12N2O5 |
2.175234266 |
0.652560084 |
0.04625 |
427.7121853 |
Pimecrolimus |
C43H68ClNO11 |
2.219307517 |
0.693689746 |
0.04594 |
294.1980295 |
Canthaxanthin |
C40H52O2 |
1.85867212 |
0.72040521 |
0.04045 |
175.0392031 |
1-Oxo-1H-2-benzopyran-3-carboxaldehyde |
C10H6O3 |
1.214054354 |
0.892444444 |
0.01691 |
229.155128 |
3-propan-2-yl-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione |
C10H16N2O2 |
2.03055264 |
0.681867832 |
0.04289 |
158.0095975 |
Phosphocreatinine |
C4H8N3O4P |
2.87048892 |
0.502759659 |
0.01559 |
527.1281352 |
Egonol glucoside |
C25H28O10 |
1.784131462 |
0.783887162 |
0.0482 |
470.106312 |
Theaflavic acid |
C21H16O10 |
2.019039917 |
0.801032566 |
0.01736 |
148.0251054 |
Ibervirin |
C5H9NS2 |
1.645077148 |
0.850324471 |
0.03456 |
207.0655953 |
CITROPTEN |
C11H10O4 |
2.065397839 |
0.625273694 |
0.04162 |
172.0970128 |
(4S,6S)-3,4,5,6-Tetrahydro-4-hydroxy-6-methyl-2H-pyran-2-one |
C6H10O3 |
1.511703978 |
0.834556033 |
0.04944 |
341.127105 |
Methionyl-Glutamine |
C10H19N3O4S |
2.894892226 |
0.334309991 |
0.03801 |
332.1111582 |
R-95913 |
C18H18FNO2S |
2.119244342 |
0.740592474 |
0.004474 |
175.1485095 |
1,2,3,4,tetrahydro-1,5,7-trimethylnapthalene |
C13H18 |
1.152057235 |
0.895678092 |
0.03137 |
178.0357795 |
DL-Sulforaphane |
C6H11NOS2 |
1.951249234 |
0.748321313 |
0.03288 |
215.0311155 |
8-Chlorotheophylline |
C7H7ClN4O2 |
1.958022247 |
0.734320557 |
0.0146 |
548.3091592 |
Cinncassiol D2 glucoside |
C26H42O11 |
2.588100354 |
0.68540038 |
0.005115 |
162.055218 |
4-Hydroxy-2-quinolone |
C9H7NO2 |
2.010428479 |
0.761569416 |
0.01143 |
209.0812365 |
5-(3',4'-Dihydroxyphenyl)-gamma-valerolactone |
C11H12O4 |
1.38752295 |
0.832493703 |
0.04378 |
508.1548089 |
L-2-Aminoadipate adenylate |
C16H23N6O10P |
2.441876124 |
0.714913244 |
0.004083 |
215.1183237 |
7-Hydroxytacrine |
C13H14N2O |
2.025336858 |
0.682776061 |
0.04476 |
261.1061423 |
Hydroxyprolyl-Glutamate |
C10H16N2O6 |
3.400463514 |
0.101367684 |
0.0185 |
218.0814032 |
3-Methylindolepyruvate |
C12H11NO3 |
1.638958847 |
0.849090909 |
0.01759 |
191.1067823 |
{(1R,2R)-2-[(2z)-5-Hydroxy-2-penten-1-yl]-3-oxocyclopentylacetic acid |
C12H18O4 |
1.279848254 |
0.923436231 |
0.01046 |
195.1382105 |
Neocnidilide |
C12H18O2 |
1.04252336 |
0.947191389 |
0.04929 |
279.1026762 |
Desmosflavone |
C18H16O4 |
1.718820716 |
0.852964119 |
0.02664 |
206.1543316 |
Dihydrodioscorine |
C13H21NO2 |
1.561470525 |
0.816051136 |
0.003173 |
222.112814 |
4-Hydroxy-2,6,6-trimethyl-3-oxo-1,4-cyclohexadiene-1-carboxaldehyde |
C10H12O3 |
2.038780349 |
0.73527016 |
0.01187 |
135.0442898 |
R-(-)-Mandelic acid |
C8H8O3 |
1.923130401 |
0.731014493 |
0.018 |
339.0653247 |
5,7-Dihydroxy-4'-methoxy-8-methylflavanone |
C17H16O5 |
1.581524301 |
0.811641067 |
0.04435 |
334.1556317 |
Phenylalanyl-Tryptophan |
C20H21N3O3 |
2.763379521 |
0.655504395 |
0.004053 |
209.1540027 |
Riesling acetal |
C13H22O3 |
1.220433156 |
0.875230486 |
0.04123 |
137.0963003 |
2-(1-Pentenyl)furan |
C9H12O |
1.204867687 |
0.89275766 |
0.02986 |
160.0250835 |
(E)-Raphanusanin |
C6H9NS2 |
2.667747815 |
0.599025255 |
0.02478 |
132.0809797 |
3-Methylindole |
C9H9N |
1.990898857 |
0.817406909 |
0.002269 |
205.0974937 |
L-Tryptophan |
C11H12N2O2 |
2.490258261 |
0.661298838 |
0.001893 |
215.081986 |
4-Quinolinecarboxylic acid |
C10H7NO2 |
2.482321265 |
0.590557482 |
0.01978 |
249.0697831 |
Tyrosyl-Cysteine |
C12H16N2O4S |
1.522836797 |
0.881093936 |
0.004528 |
556.1069904 |
Dermatan |
C18H31NO14S |
1.336624727 |
0.904897379 |
0.03165 |
226.0866619 |
1-Hydroxy-10-methylacridone |
C14H11NO2 |
1.247164667 |
0.892188336 |
0.03238 |
320.1170212 |
Epsilon-(gamma-Glutamyl)-lysine |
C11H21N3O5 |
1.114360557 |
0.886113886 |
0.04471 |
104.0533741 |
2-Methylthiazolidine |
C4H9NS |
2.262661514 |
0.712335693 |
0.006966 |
207.0593045 |
Indolylmethylthiohydroximate |
C10H10N2OS |
1.547536814 |
0.853518574 |
0.001266 |
192.0659442 |
2-{[hydroxy(2-methoxyphenyl)methylidene]amino}acetic acid |
C10H11NO4 |
1.464296912 |
0.859460809 |
0.02836 |
551.3675514 |
(3b,16a,21b,22a)-12-Oleanene-3,16,21,23,28-pentol-22-angeloyloxy-23-al |
C35H54O7 |
2.273475675 |
0.701647875 |
0.03017 |
318.1567734 |
2-(3-Hydroxyphenyl)ethanol 1'-glucoside |
C14H20O7 |
1.670972443 |
0.885862069 |
0.01386 |
146.0602316 |
Indole-3-carboxaldehyde |
C9H7NO |
1.44633741 |
0.886054096 |
0.04938 |
346.069578 |
Cochliophilin A |
C16H10O5 |
2.007206951 |
0.758194655 |
0.01371 |
164.0469473 |
(S)-Isowillardiine |
C7H9N3O4 |
2.609031891 |
0.55723305 |
0.01135 |
170.060175 |
N-Cinnamoylglycine |
C11H11NO3 |
2.461140769 |
0.43032049 |
0.03156 |
263.1395153 |
L-phenylalanyl-L-proline |
C14H18N2O3 |
2.515837048 |
0.682747343 |
0.01846 |
136.0759556 |
2-Phenylacetamide |
C8H9NO |
1.212987977 |
0.915917991 |
0.0181 |
158.0813124 |
2-Hydroxyethylclavam |
C7H11NO3 |
1.584284366 |
0.85918619 |
0.006938 |
215.1028348 |
N2-Succinyl-L-ornithine |
C9H16N2O5 |
1.86050467 |
0.714202391 |
0.04268 |
292.0788124 |
Linamarin |
C10H17NO6 |
2.047684699 |
0.765077821 |
0.01037 |
117.0736955 |
2-Methyl-1-methylthio-2-butene |
C6H12S |
2.157524575 |
0.759408912 |
0.00655 |
163.9837063 |
Raphanusamic acid |
C4H5NO2S2 |
2.884861381 |
0.608154944 |
0.009327 |
520.2635865 |
11-Hydroxyprogesterone 11-glucuronide |
C27H38O9 |
2.21978892 |
0.604443162 |
0.03875 |
117.0550738 |
Alpha-ketoisovaleric acid |
C5H8O3 |
1.554512262 |
0.847489738 |
0.001027 |
263.0523276 |
Benzoyl glucuronide (Benzoic acid) |
C13H14O8 |
2.15676507 |
0.712403323 |
0.004456 |
180.0657319 |
Adrenochrome |
C9H9NO3 |
2.069599505 |
0.78973393 |
0.002385 |
139.0867471 |
2,4-Diaminoanisole |
C7H10N2O |
1.760802856 |
0.851221466 |
0.01367 |
297.0399462 |
3-(2,5-dihydroxy-4-methoxyphenyl)-6,7,8-trihydroxy-4H-chromen-4-one |
C16H12O8 |
1.87701834 |
0.7583399 |
0.03086 |
89.0425623 |
Cis-2,3-Dimethylthiirane |
C4H8S |
1.89277777 |
0.808803913 |
0.01501 |
204.0506068 |
3-Fumarylpyruvate |
C7H6O6 |
2.650917572 |
0.785977181 |
6.96E-05 |
117.0549626 |
2methyl-3-ketovaleric acid |
C5H8O3 |
1.238531143 |
0.909182644 |
0.03561 |
203.1504826 |
ADMA |
C8H18N4O2 |
1.272351038 |
0.409230769 |
0.03835 |
165.0758211 |
11-Hydroxyprogesterone 11-glucuronide |
C6H14O6 |
2.029510943 |
0.655991165 |
0.04619 |
132.0656573 |
Trans-4-Hydroxy-L-proline |
C5H9NO3 |
1.38260063 |
0.740924913 |
5.14E-05 |
689.2122744 |
Stachyose |
C24H42O21 |
1.230116853 |
0.808257638 |
0.03233 |
665.5842526 |
9(R)-HODE cholesteryl ester |
C45H76O3 |
2.604224801 |
0.395860495 |
0.001219 |
118.0863816 |
Betaine |
C5H11NO2 |
1.161890218 |
0.90842442 |
0.00121 |
330.0935837 |
Amoxicillin |
C16H19N3O5S |
1.238582843 |
0.767499437 |
0.00447 |
144.0807517 |
2-Naphthylamine |
C10H9N |
1.677289415 |
0.735265431 |
0.009176 |
188.0709129 |
3-amino-2-naphthoic acid |
C11H9NO2 |
1.495827215 |
0.743767573 |
0.008582 |
395.2911367 |
7,8-Dehydro-beta-micropteroxanthin |
C27H38O2 |
1.32836933 |
0.848883049 |
0.000134 |
487.3428115 |
Alisol C |
C30H46O5 |
1.232155679 |
0.72293578 |
0.02673 |
407.219997 |
12alpha-Hydroxy-3-oxochola-1,4,6-trien-24-oic Acid |
C24H32O4 |
1.848450052 |
0.686528497 |
6.46E-05 |
215.1394345 |
D-Dethiobiotin |
C10H18N2O3 |
1.693484851 |
0.667572464 |
0.0001254 |
121.065066 |
P-Tolualdehyde |
C8H8O |
1.992266916 |
0.733934283 |
7.52E-05 |
162.076264 |
Pyroglutamic acid |
C5H7NO3 |
1.875375131 |
0.528041181 |
0.001026 |
176.0918386 |
N-Carboxyethyl-gamma-aminobutyric acid |
C7H13NO4 |
1.381360273 |
0.830349229 |
0.0009188 |
222.1338658 |
N-lactoyl-Valine |
C8H15NO4 |
1.461137724 |
0.742272727 |
0.01644 |
118.086576 |
L-Valine |
C5H11NO2 |
1.185474029 |
0.887396226 |
0.005473 |
220.118182 |
D-Pantothenic acid |
C9H17NO5 |
1.333382266 |
0.81716663 |
3.42E-06 |
208.133505 |
(1xi,4xi,6xi)-Carvone oxide |
C10H14O2 |
2.687298601 |
0.060368544 |
0.0007359 |
190.1075753 |
N-Methylcalystegine B2 |
C8H15NO4 |
1.029729661 |
0.780383186 |
0.009808 |
246.1703217 |
2-Methylbutyroylcarnitine |
C12H23NO4 |
1.005160282 |
0.817808571 |
0.04581 |
232.154797 |
Isobutyryl carnitine |
C11H21NO4 |
1.285682185 |
0.795703946 |
0.0007375 |
221.0808082 |
2,6-Dioxo-6-phenylhexanoate |
C12H12O4 |
1.381787356 |
0.599235519 |
0.02316 |
393.2754149 |
3-Hydroxy-10'-apo-b,y-carotenal |
C27H36O2 |
1.413759953 |
0.814967259 |
0.000119 |
426.1940115 |
Kanzonol N |
C22H24O6 |
1.091618058 |
0.871246246 |
0.008901 |
377.2805347 |
10'-apo-beta-carotenal |
C27H36O |
1.316525996 |
0.850334305 |
0.0001803 |
399.3226623 |
1alpha,25-dihydroxy-9,11-didehydro-3-deoxyvitamin D3 |
C27H42O2 |
1.026653574 |
0.865434783 |
0.01144 |
375.2648843 |
Docosadienoate (22:2n6) |
C22H40O2 |
1.626182871 |
0.69928667 |
0.0005543 |
415.3173691 |
Setariol |
C27H42O3 |
1.41525567 |
0.782392386 |
0.0007405 |
174.0406958 |
4,5-Dihydro-5-methyl-3-thiophenethiol |
C5H8S2 |
1.004974844 |
0.810749186 |
0.01591 |
226.1077942 |
L-4-Hydroxy-3-methoxy-a-methylphenylalanine |
C11H15NO4 |
1.096440079 |
0.750062988 |
0.01625 |
208.0971492 |
Rhexifoline |
C11H13NO3 |
1.150060485 |
0.710149166 |
0.01494 |
192.1021982 |
4-Ethoxybenzaldehyde |
C9H10O2 |
1.391284686 |
0.718801539 |
0.001974 |
173.1075544 |
NORELEAGNINE |
C11H12N2 |
1.524032747 |
0.672031212 |
0.003183 |
171.0918769 |
2-Amino-5-phenylpyridine |
C11H10N2 |
1.387092349 |
0.779584277 |
7.47E-05 |
180.1021615 |
N-Acetyltyramine |
C10H13NO2 |
1.191108945 |
0.819741481 |
0.003837 |
232.1548149 |
Butyryl-L-carnitine |
C11H21NO4 |
1.715785742 |
0.47408051 |
0.02834 |
202.058461 |
Isocolumbin |
C20H22O6 |
1.152282484 |
0.780523256 |
0.01246 |
251.1394956 |
Caffeoylputrescine |
C13H18N2O3 |
1.409994252 |
0.680879121 |
0.02955 |
148.0758501 |
INDOLE-3-CARBINOL |
C9H9NO |
1.115604858 |
0.796278626 |
0.02604 |
220.1183375 |
Pantothenic Acid |
C9H17NO5 |
1.642845241 |
0.725228272 |
0.004396 |
189.0073658 |
Alpha-Fluoro-beta-ureidopropionic acid |
C4H7FN2O3 |
1.465630055 |
0.721371709 |
0.002484 |
77.06040416 |
1,3-Propanediol |
C3H8O2 |
1.582739284 |
0.683584264 |
0.0001784 |
527.1594841 |
1-Kestose |
C18H32O16 |
1.55501058 |
0.701506245 |
0.02238 |
188.1282478 |
3-hydroxyheptanoic acid |
C7H14O3 |
1.671833191 |
0.698321649 |
0.0005467 |
220.1181122 |
2-O-Methyl-L-fucose |
C7H14O5 |
1.749895787 |
0.702608696 |
2.44E-05 |
101.0600024 |
2-Ethylacrylic acid |
C5H8O2 |
1.806588782 |
0.750922213 |
1.04E-06 |
188.1758827 |
N1-Acetylspermidine |
C9H21N3O |
1.617652422 |
0.774978578 |
0.002106 |
160.1333685 |
METHACHOLINE |
C8H17NO2 |
1.691271785 |
0.677038109 |
4.20E-06 |
263.2372177 |
Linoleic acid |
C18H32O2 |
1.352169651 |
0.851196329 |
0.03838 |
132.0656573 |
Trans-4-Hydroxy-L-proline |
C5H9NO3 |
1.867926684 |
0.692057594 |
0.001464 |
565.1564416 |
Apiin |
C26H28O14 |
2.097536921 |
0.660624551 |
0.01451 |
369.1727038 |
Quercetol C |
C22H24O5 |
1.016354691 |
0.907909605 |
0.01797 |
671.3780223 |
Phytolaccoside A |
C36H56O10 |
1.395740126 |
0.833242009 |
0.03876 |
437.1272588 |
Para-hydroxyrosiglitazone |
C18H19N3O4S |
1.690840196 |
0.729662361 |
0.006775 |
446.1641876 |
Neolinustatin |
C17H29NO11 |
1.625058167 |
0.654886803 |
0.02886 |
487.3428115 |
Alisol C |
C30H46O5 |
1.618683744 |
0.741220736 |
0.01598 |
137.0598335 |
Benzylformate |
C8H8O2 |
1.549603749 |
0.803608737 |
0.01765 |
407.219997 |
12alpha-Hydroxy-3-oxochola-1,4,6-trien-24-oic Acid |
C24H32O4 |
2.288070638 |
0.695652174 |
0.0004605 |
125.0599248 |
P-Methylolphenol |
C7H8O2 |
1.14943481 |
0.86203847 |
0.03443 |
191.1069182 |
(R)-3,7-Dimethyl-5-indanecarboxylic acid |
C12H14O2 |
1.195838985 |
0.825458052 |
0.03843 |
75.05597202 |
N-Methylurea |
C2H6N2O |
1.254449906 |
0.827370304 |
0.01523 |
281.08029 |
Gamma-Glutamyl-S-methylcysteine sulfoxide |
C9H16N2O6S |
1.647287262 |
0.754361339 |
0.01396 |
222.1338658 |
N-lactoyl-Valine |
C8H15NO4 |
1.46940662 |
0.762727697 |
0.02713 |
220.118182 |
D-Pantothenic acid |
C9H17NO5 |
1.271832463 |
0.867503487 |
0.0001832 |
291.0392706 |
N5-(3,4-Dioxo-1,5-cyclohexadien-1-yl)-L-glutamine |
C11H12N2O5 |
1.850808617 |
0.588296761 |
0.01681 |
209.1175726 |
(4-tert-Butyl-phenoxy)-acetic acid |
C12H16O3 |
1.603682692 |
0.779003088 |
0.003158 |
217.0498642 |
ISOBERGAPTENE |
C12H8O4 |
2.684947086 |
0.422617843 |
0.004417 |
218.0814032 |
3-Methylindolepyruvate |
C12H11NO3 |
1.252178535 |
0.852727273 |
0.007778 |
432.2727937 |
Gamma-Eudesmol rhamnoside |
C21H36O5 |
1.135897354 |
0.857176526 |
0.03914 |
418.2568652 |
4-Hydroxy-D4-neuroprostane |
C22H32O5 |
1.2734631 |
0.842557652 |
0.0412 |
376.2463469 |
(ent-16betaOH)-16,17-Dihydroxy-9(11)-kauren-19-oic acid |
C20H30O4 |
1.439696342 |
0.774355301 |
0.03734 |
195.1382105 |
Neocnidilide |
C12H18O2 |
1.012091056 |
0.925832492 |
0.01384 |
445.3139915 |
Hydroxysintaxanthin 5,6-epoxide |
C31H42O3 |
1.184997554 |
0.84363879 |
0.02443 |
396.2727566 |
PGE2-EA |
C22H37NO5 |
1.246325863 |
0.852593842 |
0.03367 |
C18H16O4 |
Desmosflavone |
C18H16O4 |
1.373241238 |
0.840678627 |
0.01035 |
255.0655761 |
Daidzein |
C15H10O4 |
1.204115555 |
0.892776755 |
0.0006034 |
223.0602868 |
3-(6-hydroxy-7-methoxy-2H-1,3-benzodioxol-5-yl)prop-2-enal |
C11H10O5 |
1.108424445 |
0.877188594 |
0.003953 |
104.0533741 |
2-Methylthiazolidine |
C4H9NS |
1.446386897 |
0.760616785 |
0.02352 |
214.0633156 |
Cysteinyl-Glutamine |
C8H15N3O4S |
1.312993536 |
0.873096447 |
0.001057 |
195.0879892 |
Caffeine |
C8H10N4O2 |
1.576412125 |
0.570684039 |
0.03142 |
195.1130541 |
4,5-Dimethyloxazole |
C5H7NO |
1.047886711 |
0.89216152 |
0.003581 |
202.058461 |
Isocolumbin |
C20H22O6 |
1.101813786 |
0.855776892 |
0.02373 |
227.1030103 |
Porphobilinogen |
C10H14N2O4 |
1.071135255 |
0.891752577 |
0.03301 |
160.1333685 |
METHACHOLINE |
C8H17NO2 |
1.511227935 |
0.737907466 |
0.02717 |
77.06040416 |
1,3-Propanediol |
C3H8O2 |
1.515237808 |
0.728142783 |
0.0174 |
117.0549626 |
2methyl-3-ketovaleric acid |
C5H8O3 |
1.407986888 |
0.845786963 |
0.0009994 |
527.1594841 |
1-Kestose |
C18H32O16 |
1.358205407 |
0.790846966 |
0.04887 |
141.018272 |
Cis-4-Carboxymethylenebut-2-en-4-olide |
C6H4O4 |
1.175827063 |
0.885444744 |
0.002208 |
101.0600024 |
2-Ethylacrylic acid |
C5H8O2 |
1.685010841 |
0.799658412 |
0.002509 |