| ID | Name | CAS | Data |
McVol (ml/mol) |
| 18-173-0 |
2,3,4,7-Tetrahydrooxepin-2-ol
|
41793-28-6 |
6 | 91.980 |
| 18-282-9 |
2,4-Dimethyl-2-oxazoline-4-methanol
|
39986-37-3 |
6 | 101.960 |
| 18-491-7 |
N-(beta-diethylaminoethyl)-2-chloro-4-aminobenzamide
|
840-10-8 |
6 | 214.020 |
| 18-613-1 |
Acetic acid, [2-[(2-propenylamino)carbonyl]phenoxy]-
|
119-45-9 |
6 | 176.740 |
| 18-672-6 |
1,5,5-Trimethyl-6-methylene-cyclohexene
|
514-95-4 |
6 | 132.300 |
| 18-780-6 |
1,3-Oxathiane, 4,6-dimethyl-, trans-
|
22452-26-2 |
6 | 106.760 |
| 19-162-1 |
2,4-Difluorobenzoic acid, 2-pentyl ester
|
|
6 | 167.160 |
| 19-182-9 |
N-Methyl-N-trifluoroacetyl-3,4-methylenedioxyamphetamine
|
158097-59-7 |
6 | 188.010 |
| 19-474-5 |
Isonipecotic acid, N-(3-chloropropionyl)-, tridecyl ester
|
|
6 | 341.210 |
| 19-528-5 |
Butanal, 3-methyl-, (2,4-dinitrophenyl)hydrazone
|
|
6 | 192.590 |
| 19-600-4 |
p-Menth-2-en-9-ol, trans-
|
|
6 | 142.470 |
| 19-670-7 |
p-mentha-1,3-dien-8-ol
|
|
6 | 138.170 |
| 19-693-2 |
Isonipecotic acid, N-(3-methylbutyryl)-, heptadecyl ester
|
|
6 | 413.510 |
| 19-754-4 |
Isonipecotic acid, N-(2-trifluoromethylbenzoyl)-, hexyl ester
|
|
6 | 282.340 |
| 19-814-7 |
2,3-Dichlorobenzyl alcohol, n-pentyl ether
|
|
6 | 186.530 |
| 20-446-4 |
5-Chloro-2-methyl-aniline, N-pentafluoropropionyl-
|
|
6 | 160.640 |
| 20-753-3 |
1,3-Oxathiolane, 2,5-dimethyl-, cis-
|
38348-52-6 |
6 | 92.670 |
| 20-762-3 |
Guaja-1(10),11-dien-15-al
|
|
6 | 193.460 |
| 20-797-5 |
Diethylmalonic acid, 2,6-dimethoxyphenyl isobutyl ester
|
|
6 | 281.430 |
| 20-848-8 |
4a«beta»,7«alpha»,7a«alpha»-Nepetalactone
|
|
6 | 133.180 |
| 20-880-2 |
Isonipecotic acid, N-(3-chloropropionyl)-, nonyl ester
|
|
6 | 284.850 |
| 21-102-4 |
4-Amino-2,3,5,6-tetrafluorobenzamide
|
1548-74-9 |
6 | 114.340 |
| 21-122-2 |
Methanimidamide, N'-(2-chlorophenyl)-N,N-dimethyl-
|
2103-49-3 |
6 | 141.810 |
| 21-204-1 |
3-Chloro-2-fluorobenzoic acid, cyclohexylmethyl ester
|
|
6 | 194.950 |
| 21-359-0 |
cis-1,2-Dimethyl-3,3-dichlorocyclopropane
|
|
6 | 94.930 |
| 21-540-8 |
Valeramide, 3-hydroxy-2,2,4-trimethyl
|
|
6 | 141.000 |
| 21-603-8 |
2,4,6-tris-Cyano-1-hexene
|
|
6 | 137.510 |
| 21-747-9 |
(R)-2-Butyl glucuronide, methyl ester, triacetate
|
|
6 | 281.030 |
| 21-829-8 |
Allylamine, n,n-bis-(2,3-epoxypropyl)-
|
49623-99-6 |
6 | 133.370 |
| 22-075-4 |
Amitriptyline N-oxide M(Desoxo-nor-HO)
|
|
6 | 227.440 |
| 22-157-3 |
2,6-Pyridinedicarboxylic acid, isobutyl phenethyl ester
|
|
6 | 255.910 |
| 22-246-4 |
Diethylmalonic acid, 3,5-dichlorophenyl nonyl ester
|
|
6 | 336.440 |
| 22-529-0 |
Propylamine, n,n-diethyl-2,3-epoxy-
|
2917-91-1 |
6 | 114.480 |
| 22-583-0 |
trans-Cinnamamide, N,N-dioctyl-3-trifluoromethyl-
|
|
6 | 366.000 |
| 22-688-4 |
(E)-1-(2',4',5'-Trimethoxyphenyl)butadiene
|
|
6 | 179.280 |
| 22-779-3 |
cadina-4,10(15)-dien-3-one
|
39765-72-5 |
6 | 193.460 |
| 23-055-5 |
2,4,6-tris-(Methoxycarbonyl)-1-hexene
|
|
6 | 197.960 |
| 23-560-4 |
2-Cyclopenten-1-one, 3-(1-methylethyl)-
|
1619-28-9 |
6 | 109.990 |
| 23-575-8 |
2,5-Dichlorobenzyl alcohol, 2-methylbutyl ether
|
|
6 | 186.530 |
| 23-636-0 |
1,2,3,4,6,7-Hexathiocane
|
|
6 | 126.280 |
| 24-009-5 |
5B-Estran-3B,17B-diol, 17A-ethyl
|
|
6 | 260.960 |
| 24-053-6 |
3,5-Dichlorobenzyl alcohol, n-propyl ether
|
|
6 | 158.350 |
| 24-250-7 |
2,3-Dichlorobenzyl alcohol, 2-methylpropyl ether
|
|
6 | 172.440 |
| 24-356-0 |
2,6-Difluorobenzoic acid,2-tetradecyl ester
|
|
6 | 293.970 |
| 24-388-5 |
l-Phenylalanine, N-(2-trifluoromethylbenzoyl)-, methyl ester
|
|
6 | 241.260 |
| 24-454-1 |
1,2-dimethyl-cis-2-pentyl-cyclopropane
|
|
6 | 140.900 |
| 24-535-1 |
2-METHYL-5,6,7,8-TETRAHYDROQUINOXALINE
|
|
6 | 123.010 |
| 24-583-8 |
2-Acetyl-3,4,5,6-tetrahydropyridine
|
27300-27-2 |
6 | 105.880 |
| 25-976-1 |
Acetic acid, tribromo, 1,2-dimethylpropyl ester
|
|
6 | 169.430 |
| 26-064-2 |
Diethylmalonic acid, 2,6-dimethoxyphenyl propyl ester
|
|
6 | 267.340 |
| 26-244-2 |
10,11-epoxy-ar-curcumen-15-al
|
|
6 | 195.030 |
| 26-246-0 |
D-(+)-Ribono-1,4-lactone, triacetate
|
|
6 | 184.750 |
| 26-271-2 |
5A-Estran-3B,17B-diol, 17A-ethyl
|
|
6 | 260.960 |
| 26-407-1 |
2,6-Diallylphenyl-n,n-dimethyl carbamate
|
|
6 | 207.270 |
| 26-439-6 |
N-(2-Methylbutyl)-(2E,6Z,8E)-decatrienamide
|
|
6 | 220.860 |
| 26-614-1 |
Isonipecotic acid, N-(3-methylbutyryl)-, hexadecyl ester
|
|
6 | 399.420 |
| 26-819-4 |
2-Methyl-1,3-diphenyl-2-thiopseudourea
|
|
6 | 192.610 |
| 27-009-2 |
Isonipecotic acid, N-(3-phenylpropionyl)-, nonyl ester
|
|
6 | 333.390 |
| 27-713-0 |
3,4,10,11-Tetradehydrocadinan-8-one
|
|
6 | 193.460 |
| 27-769-9 |
«alpha»-Cedr-8(15)-en-9-al
|
|
6 | 191.200 |
| 28-173-9 |
1,2,4-Trithiolane, 3,5-diethyl-
|
54644-28-9 |
6 | 133.590 |
| 28-507-8 |
1,3-Oxathiane, 4,6-dimethyl-, cis-
|
22452-25-1 |
6 | 106.760 |
| 29-266-5 |
D-Ile, N-ethoxycarbonyl, (S)-1-phenylethylamide
|
|
6 | 255.600 |
| 29-457-3 |
2,3-Dimethyl-4-penten-2-ol
|
19781-52-3 |
6 | 111.060 |
| 29-515-8 |
2,5-Dimethyl-3-(1-hydroxyethyl)-furan
|
|
6 | 124.080 |
| 29-525-7 |
4-(Trifluoromethyl)phenyl methanol, 2-methylpropyl ether
|
|
6 | 167.360 |
| 29-639-1 |
2,6-Difluorobenzoic acid, 4-cyanophenyl ester
|
|
6 | 172.960 |
| 29-781-3 |
4-Amino-3-chloro-5-methyl benzonitrile
|
158296-69-6 |
6 | 123.420 |
| 29-791-2 |
2-Fluoro-3-trifluoromethylbenzoic acid, neopentyl ester
|
|
6 | 184.790 |
| 29-809-2 |
1-(6-Methyl-2-pyrazinyl)-1-ethanone
|
22047-26-3 |
6 | 107.260 |
| 29-880-3 |
2-Pentene, 3-ethyl-4,4-dimethyl-
|
53907-59-8 |
6 | 133.370 |
| 29-904-6 |
2«beta»-hydroxy-trans-decalin-6-one
|
|
6 | 137.480 |
| 30-019-7 |
2,3,5-Triiodobenzyl alcohol, isopropyl ether
|
|
6 | 211.330 |
| 30-055-7 |
1,4-Cyclohexadiene, 1-iodo-6-methyl
|
|
6 | 115.850 |
| 30-263-6 |
2-Thiopheneacetic acid, 3,5-dimethylphenyl ester
|
|
6 | 188.690 |
| 30-360-8 |
Dimethylmalonic acid, 2,5-dichlorophenyl tridecyl ester
|
|
6 | 364.620 |
| 30-508-4 |
Isonipecotic acid, N-(2-methoxybenzoyl)-, propyl ester
|
|
6 | 240.630 |
| 30-799-2 |
3Alpha,5alpha-cycloandrostane, 6beta-acetamido-17beta-acetoxy-
|
|
6 | 299.620 |
| 31-510-0 |
2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL
|
|
6 | 100.450 |
| 31-562-3 |
Fumaric acid, 3,4-dimethoxyphenyl isohexyl ester
|
|
6 | 263.040 |
| 31-692-9 |
Fenproporex-M (N-desalkyl-HO-methoxy-), 2AC
|
|
6 | 209.220 |
| 32-241-8 |
[2H8]-2-Chloro-1-(Chloromethyl)-4-methylbenzene
|
|
6 | 124.300 |
| 32-424-5 |
cedr-8(15)-en-9-«alpha»-ol
|
|
6 | 191.200 |
| 32-687-4 |
Isonipecotic acid, N-(2-trifluoromethylbenzoyl)-, octyl ester
|
|
6 | 310.520 |
| 32-693-7 |
2,5-Difluorobenzoic acid, 2-pentyl ester
|
|
6 | 167.160 |
| 32-850-2 |
(trans-2,3-Methylene)-7-octenyl-cyclopropane
|
|
6 | 153.920 |
| 32-972-7 |
Isonipecotic acid, N-(3-chloropropionyl)-, octyl ester
|
|
6 | 270.760 |
| 33-074-3 |
l-Methionine, N-(3-fluorobenzoyl)-, methyl ester
|
|
6 | 207.380 |
| 33-235-4 |
L-(+)-Erythrulose, acetyloxime, triacetate (isomer 2)
|
|
6 | 215.380 |
| 33-930-2 |
3-Cyclopentylpropionic acid, 3,4-dichlorophenyl ester
|
|
6 | 205.420 |
| 34-328-0 |
2-Ethyl-2,3-dimethyl-oxirane (E)
|
|
6 | 90.410 |
| 34-561-1 |
2,5-dimethyl-3-cis-propenyl pyrazine
|
|
6 | 129.570 |
| 34-789-9 |
L-Homoserine, N,O-dimethyl-, methyl ester
|
|
6 | 132.780 |
| 34-949-1 |
Bicyclo[3.3.0]octan-1-ol
|
|
6 | 107.730 |
| 35-070-5 |
2-Propenoic acid, 3-(2-thienyl)-, (E)-
|
15690-25-2 |
6 | 109.520 |
| 35-170-4 |
trans-Cinnamamide, N,N-dibutyl-3-trifluoromethyl-
|
|
6 | 253.280 |
| 35-265-9 |
L-Proline, N-(4-bromobenzoyl)-, methyl ester
|
|
6 | 195.900 |
| 35-494-5 |
Isonipecotic acid, N-(3-methylbenzoyl)-, ethyl ester
|
|
6 | 220.670 |
| 36-195-6 |
Diethylmalonic acid, 2,3-dichlorophenyl propyl ester
|
|
6 | 251.900 |
| 36-376-5 |
L-(+)-Erythrulose, acetyloxime, triacetate (isomer 1)
|
|
6 | 215.380 |
|
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