| ID | Name | CAS | Data |
McVol (ml/mol) |
| 82-473-6 |
Benzamide, N-(2-iodo-4-methylphenyl)-2,3,4-trifluoro-
|
|
3 | 203.280 |
| 82-521-2 |
2H,8H-Benzo[1,2-b:3,4-b']dipyran-2-one, 9,10-dihydro-9-hydroxy-8,8-dimethyl-, (R)-
|
19380-05-3 |
3 | 177.520 |
| 82-538-4 |
2H,8H-Benzo[1,2-b:3,4-b']dipyran-2-one, 8,8-dimethyl-
|
|
3 | 167.350 |
| 82-563-6 |
2H-Furo[2,3-h]-1-benzopyran-2-one, 8-(1-methylethenyl)-
|
1760-27-6 |
3 | 163.050 |
| 82-655-4 |
3-Carboxy-4-methyl-5-propyl-2-furanpropionic acid, dimethyl ester
|
|
3 | 209.410 |
| 82-998-4 |
Benzamide, N-(2-piperidinylmethyl)-2,5-bis(2,2,2-trifluoroethoxy)-
|
54143-55-4 |
3 | 259.660 |
| 83-214-2 |
6-Methyl-6-(5-methylfuran-2-yl)heotan-2-one
|
|
3 | 182.010 |
| 83-351-0 |
1,3,2-Diazaphosphol-4-ene, 2-chloro-1,3-dibutyl-4,5-dimethyl-
|
|
3 | 217.440 |
| 83-396-1 |
s-Triazine, 2-chloro, 4-(1-methylethyl)amino-6-(1,1-dimethylethyl)amino
|
|
3 | 190.140 |
| 83-471-7 |
6-Methyl-3-(2-nitroxyethyl)-2H-1,3-benzoxazin-4(3H)-one
|
|
3 | 171.940 |
| 83-476-2 |
Pyrazolo[1,5-d][1,2,4]triazin-3-one, 2,6-dimethyl-7,7-tetramethylene
|
|
3 | 166.160 |
| 83-506-8 |
1,3,2-Dioxaphosphorinane, 5,5-dimethyl-2-phenoxy-, 2-oxide
|
|
3 | 175.170 |
| 83-542-8 |
1-Aminocyclopentanecarboxylic acid, N-(but-2-yn-1-yloxycarbonyl)-, butyl ester
|
|
3 | 227.610 |
| 83-544-6 |
2-Aminopent-4-enoic acid, N-(but-2-yn-1-yloxycarbonyl)-, pentyl ester
|
|
3 | 234.170 |
| 83-888-5 |
1-Aminocyclopentanecarboxylic acid, N-(but-3-yn-1-yloxycarbonyl)-, tetradecyl ester
|
|
3 | 368.510 |
| 83-889-4 |
1-Aminocyclopentanecarboxylic acid, N-(but-2-yn-1-yloxycarbonyl)-, tetradecyl ester
|
|
3 | 368.510 |
| 84-511-1 |
1-Aminocyclopentanecarboxylic acid, N-(but-3-yn-1-yloxycarbonyl)-, undecyl ester
|
|
3 | 326.240 |
| 84-664-2 |
4-([(2E)-3,7-dimethyl-2,6-octadienyl]oxy)-7h-furo[3,2-g]chromen-7-one
|
|
3 | 263.250 |
| 84-728-1 |
6-Chloro-N,N'-(cyclobutyl)-[1,3,5]triazine-2,4-diamine
|
|
3 | 182.510 |
| 84-742-5 |
R,S-4'-methyl-.alpha.-pyrrolidinohexanophenone-M (di-HO-), 2AC
|
|
3 | 298.560 |
| 84-824-4 |
Glycine, 2-cyclohexyl-N-(but-3-yn-1-yl)oxycarbonyl-, isohexyl ester
|
|
3 | 283.970 |
| 84-952-2 |
2H-1-Benzopyran-2-one, 3-(1,1-dimethyl-2-propenyl)-7-hydroxy-6-methoxy-
|
19723-23-0 |
3 | 198.170 |
| 84-971-1 |
1-(8-Bromo-2,3,6,7-tetrahydrodibenzo[1,2-b; 4,5-b']difuran-4-yl-2-aminopropane, TFA
|
|
3 | 222.830 |
| 85-008-9 |
(R)-3,5,8a-Trimethyl-7,8,8a,9-tetrahydronaphtho[2,3-b]furan-4(6H)-one
|
151590-41-9 |
3 | 184.170 |
| 85-515-6 |
5-Methyl-2H-pyrazole-3-carboxylic acid, 1-methyl-2-phenylhydrazide
|
|
3 | 178.210 |
| 85-594-9 |
2H-Pyrido[2,1-b]quinazolin-6-one, 1,3,4,6,7,8,9,10-octahydro-8-methyl
|
|
3 | 170.270 |
| 85-597-6 |
Ketone, 1,3-dimethyl-4-nitro-pyrazol-5-yl phenyl,
|
|
3 | 175.670 |
| 85-620-9 |
1H,2H,3H,4H-Pyrido[2,1-b]quinazolin-11-one
|
25816-55-1 |
3 | 151.690 |
| 85-623-6 |
4H-Cyclopenteno[2,3-e]pyrido[1,2-a]pyrimidin-4-one, 6,7,8,9-tetrahydro, 8-methyl
|
|
3 | 151.690 |
| 85-716-3 |
Pyrazolo[1,5-d][1,2,4]triazin-3-one, 2,6-dimethyl-7,7-pentamethylene
|
|
3 | 180.250 |
| 85-835-1 |
5,6-Dihydro-3,6-dimethyl-benzo-[b]-furan-7(4H)-one
|
|
3 | 128.880 |
| 85-852-2 |
5-(Furan-3-yl)-2-methylpent-1-en-3-one
|
|
3 | 135.440 |
| 86-080-8 |
5-Methyl-2H-pyrazole-3-carboxylic acid, 2,2-pentamethylene hydrazide
|
|
3 | 162.930 |
| 86-093-4 |
2-Azabicyclo[2.2.2]octane-2-carboxylic acid, 5-oxo-, ethyl ester
|
|
3 | 149.030 |
| 86-124-9 |
7-acetyl-5,6-dimethyl-2,3-dihydro-(1H)-pyrrolizine
|
|
3 | 147.080 |
| 86-280-6 |
L-Cysteine, S-(2-methoxy-2-oxoethyl)-N-[N-[N-[N-(1-oxopropyl)-L-phenylalanyl]-L-leucyl]glycyl]-, methyl ester
|
35146-63-5 |
3 | 444.960 |
| 87-141-9 |
1-Naphthalenecarboxylic acid, 5-[2-(3-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-, methyl ester, [4aS-(4a«alpha»,5«alpha»,6«beta»,8a«beta»)]-
|
56630-98-9 |
3 | 274.580 |
| 87-382-2 |
2-(7,8-Dioxa-bicyclo[4.2.0]octa-1,3,5-trien-3-yl)-7-ethyl-3-methyl-5-propenyl-2,3-dihydro-benzofuran
|
|
3 | 236.730 |
| 87-383-1 |
4H-1-Benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-5-hydroxy-3,6,7-trimethoxy-
|
479-90-3 |
3 | 272.640 |
| 87-447-0 |
(4aS,5R,6S,8aS)-5-(2-(Furan-3-yl)ethyl)-5,6,8a-trimethyl-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylic acid
|
|
3 | 260.490 |
| 88-176-0 |
Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 2
|
|
3 | 334.860 |
| 88-185-0 |
(4aS,7S,7aR)-2,4,7-Trimethyl-2,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridin-1-one
|
|
3 | 151.380 |
| 88-280-4 |
2,4-dimethyl-3-oxa-8-thiabicyclo[3.3.0]-1,4-octadiene
|
|
3 | 115.480 |
| 89-227-2 |
(5R,6S,8S,Z)-8-Methoxy-3,6,10-trimethyl-4-oxo-4,5,6,7,8,11-hexahydrocyclodeca[b]furan-5-yl acetate
|
383368-25-0 |
3 | 250.610 |
| 89-450-4 |
2-(N-n-hexyl-n-n-octylamino)-3-methyl pyrazine
|
|
3 | 284.750 |
| 89-749-3 |
2-O-methyl-8,12-epoxygermacra-1(10),4,7,11-tetraene, isomer I
|
|
3 | 209.120 |
| 89-751-0 |
2-O-methyl-8,12-epoxygermacra-1 (10),4,7,11-tetraene, isomer II
|
|
3 | 209.120 |
| 89-752-9 |
(R,5E,9E)-8-Methoxy-3,6,10-trimethyl-4,7,8,11-tetrahydrocyclodeca[b]furan
|
108376-98-3 |
3 | 209.120 |
| 89-922-0 |
1-(8-Bromo-2,3,6,7-tetrahydrodibenzo[1,2-b; 4,5-b']difuran-4-yl-2-aminoethane, TFA
|
|
3 | 208.740 |
| 90-164-0 |
2,4-Pentanedione, 1-(7-acetyl-4,6-dihydroxy-3,5-dimethyl-2-benzofuranyl)-
|
21402-79-9 |
3 | 233.790 |
| 90-462-9 |
Phenethylamine, 2,5-dimethoxy-4-propylthio, N-acetyl, sulfone, acetoxy-M
|
|
3 | 285.450 |
| 90-633-9 |
Glycine, 2-cyclohexyl-N-(but-3-yn-1-yl)oxycarbonyl-, hexadecyl ester
|
|
3 | 424.870 |
| 90-713-0 |
Ethanone, 1-[3-[2-methyl-2-(5-methyl-2-furanyl)propyl]oxiranyl]-
|
80114-28-9 |
3 | 177.020 |
| 90-717-6 |
Furan-3-carboxylic acid, 5-ethyl-4-methyl-2-(2-methoxycarbonylethyl), methyl ester
|
|
3 | 195.320 |
| 90-951-6 |
2-Azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid, ethyl ester
|
|
3 | 143.160 |
| 90-979-6 |
Pyrrolidino[1,2-e]-4H-1,3,5-dithiazine, 4-methyl-2-propyl
|
|
3 | 172.720 |
| 91-064-0 |
2,3,5,6,7,8-Hexahydro-1H-4,8a-diaza-cyclopenta[b]naphthalen-9-one
|
|
3 | 146.200 |
| 91-135-1 |
4-Carboxy-1-piperidineacetic acid, 4-ethyl-1, methyl ester
|
|
3 | 179.850 |
| 91-448-4 |
Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 1
|
|
3 | 334.860 |
| 91-524-9 |
L-Valine, N-(3-methoxy-2,4,5-trifluorobenzoyl)-, dodecyl ester
|
|
3 | 369.520 |
| 91-658-1 |
Benzoic acid, 2-(8'-trifluoromethyl-4'-quinolylamino)-, 2,3-dihydroxypropyl ester
|
23779-99-9 |
3 | 270.130 |
| 91-733-7 |
5'-methyl-5-(3-buten-1-ynyl)-2,2'-bithienyl
|
|
3 | 174.910 |
| 91-892-1 |
Phenanthro[1,2-b]furan-10,11-dione, 6,7,8,9-tetrahydro-1,6,6-trimethyl-
|
|
3 | 222.640 |
| 92-751-6 |
S-Isobutyl, S-2-(2-(2-diethylaminoethylthio)ethylthio))ethyl methyldithiophosphonate
|
|
3 | 309.830 |
| 92-778-7 |
2-Isopropenyl-2,3-dihydrofuro[3,2-g]chromen-7-one
|
32375-25-0 |
3 | 167.350 |
| 93-156-6 |
5-(5-Methyl-2-furyl)-6-methyl-2,3-dihydro-1H-pyrrolizine
|
|
3 | 160.100 |
| 93-348-3 |
1',3',5',6'-Tetramethylspiro[cyclopentane-1,2'-(2,3-dihydrobenzimidazole)]
|
75751-20-1 |
3 | 196.690 |
| 93-359-1 |
Phenethylamine, 2,5-dimethoxy-4-propylthio, N-acetyl, hydroxy-M
|
|
3 | 243.960 |
| 93-360-9 |
1-Aminocyclopentanecarboxylic acid, N-(but-2-yn-1-yloxycarbonyl)-, isobutyl ester
|
|
3 | 227.610 |
| 93-362-7 |
1-Aminocyclopentanecarboxylic acid, N-(but-3-yn-1-yloxycarbonyl)-, butyl ester
|
|
3 | 227.610 |
| 93-364-5 |
1-Aminocyclopentanecarboxylic acid, N-(but-3-en-1-yloxycarbonyl)-, but-3-en-1-yl ester
|
|
3 | 227.610 |
| 93-365-4 |
1-Aminocyclopentanecarboxylic acid, N-(but-3-yn-1-yloxycarbonyl)-, isobutyl ester
|
|
3 | 227.610 |
| 93-407-7 |
6-Chloro-N,N'-(cyclohexyl)-[1,3,5]triazine-2,4-diamine
|
|
3 | 238.870 |
| 93-572-4 |
3,8a-Dimethyl-5-methylene-5,6,8a,9-tetrahydronaphtho[2,3-b]furan-4(4aH)-one
|
174657-08-0 |
3 | 179.870 |
| 93-641-7 |
1-Aminocyclopentanecarboxylic acid, N-(but-3-yn-1-yloxycarbonyl)-, but-3-yn-1-yl ester
|
|
3 | 219.010 |
| 93-645-3 |
1-Aminocyclopentanecarboxylic acid, N-(but-2-yn-1-yloxycarbonyl)-, but-2-yn-1-yl ester
|
|
3 | 219.010 |
| 93-662-4 |
1-(4-Methylphenyl)-2-(pyrrolidin-2-one-1-yl)-1-butanone
|
|
3 | 200.710 |
| 93-714-6 |
1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, decahydro-3-methyl-
|
|
3 | 168.890 |
| 93-961-2 |
N,N'-(4-Chloro-1,2-phenylene)bis(2,2,3,3,3-pentafluoropropanamide)
|
|
3 | 209.220 |
| 94-017-9 |
3H-Pyrimidin-4-one, 2,3-trimethyleno-5,6-tetramethyleno-6-methyl
|
|
3 | 160.290 |
| 94-046-7 |
L-Glutamine, N,N'-di(trifluoroacetyl)-, 2,2,3,3,3-pentafluoropropyl ester
|
|
3 | 231.520 |
| 94-079-1 |
3H-Pyrazol-3-one, 2,4-dihydro-4,4,5-trimethyl-2-phenyl-
|
|
3 | 162.550 |
| 94-120-4 |
4H-Cyclopenteno[2,3-e]pyrido[1,2-a]pyrimidin-4-one, 7-methyl
|
|
3 | 147.390 |
| 94-121-3 |
4H-Cyclopenteno[2,3-e]pyrido[1,2-a]pyrimidin-4-one, 8-methyl
|
|
3 | 147.390 |
| 94-122-2 |
4H-Cyclopenteno[2,3-e]pyrido[1,2-a]pyrimidin-4-one, 6-methyl
|
|
3 | 147.390 |
| 94-123-1 |
1H-Pyrrole-2,5-dione, 1-[4-(dimethylamino)-3,5-dinitrophenyl]-
|
3475-74-9 |
3 | 198.960 |
| 94-132-1 |
1-(8-Bromo-dibenzo[1,2-b; 4,5-b']difuran-4-yl-2-aminoethane
|
|
3 | 165.080 |
| 94-160-0 |
4H-Cyclopenteno[2,3-e]pyrido[1,2-a]pyrimidin-4-one, 6,7,8,9-tetrahydro, 6-methyl
|
|
3 | 151.690 |
| 94-162-8 |
4H-cyclopenteno[2,3-e]pyrido[1,2-a]pyrimidin-4-one, 6,7,8,9-tetrahydro, 9-methyl
|
|
3 | 151.690 |
| 94-180-8 |
5-(5-methyl-2-furyl)-2,3-dihydro-1H-pyrrolizine
|
|
3 | 146.010 |
| 94-229-4 |
11H-Pyrido[2,1-b]quinazolin-11-one, 1,2,3,4,6,7,8,9-octahydro
|
|
3 | 164.590 |
| 94-306-8 |
2H pyran-2-one,4-methyl-6-(2-methyl-1-propenyl)
|
|
3 | 135.440 |
| 94-365-3 |
2H-1,4Benzoxazin-6(8aH)-one, 3,4-dihydro-8a-hydroxy-4,7-dimethyl
|
|
3 | 144.730 |
| 94-399-6 |
2-(5-methyl-2-furyl)-3,4,5,6-tetrahydropyridine
|
|
3 | 132.990 |
| 94-451-7 |
4H-Pyrido[1,2-a]pyrimidin-4-one, 2,3-dimethyl
|
|
3 | 134.370 |
| 94-523-7 |
1-Piperidinecarboxaldehyde, 2-(3,4-dihydro-2H-pyrrol-5-yl)-
|
52196-11-9 |
3 | 147.270 |
| 94-536-3 |
Pyrazolo[1,5-d][1,2,4]triazin-3-one, 2,5,6,7,7-pentamethyl
|
|
3 | 162.930 |
| 94-537-2 |
5-Methyl-2H-pyrazole-3-carboxylic acid, 1-methyl-2,2-tetramethylene hydrazide
|
|
3 | 162.930 |
| 94-659-7 |
Glycine, 2-cyclohexyl-N-(but-3-en-1-yl)oxycarbonyl-, octyl ester
|
|
3 | 316.450 |
| 94-828-9 |
Glycine, 2-cyclohexyl-N-(but-3-en-1-yl)oxycarbonyl-, tetradecyl ester
|
|
3 | 400.990 |
|
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