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Cholest-3-eno-[3,4-b]pyridine, 6'-pyrrolidin-1-yl-
SpectraBase Compound ID DJjB9A4Nobf
InChI InChI=1S/C34H54N2/c1-23(2)9-8-10-24(3)27-14-15-28-25-11-13-29-26-12-16-32(36-21-6-7-22-36)35-31(26)18-20-34(29,5)30(25)17-19-33(27,28)4/h12,16,23-25,27-30H,6-11,13-15,17-22H2,1-5H3
InChIKey PVCCPDGFJCXWDE-UHFFFAOYSA-N
Mol Weight 490.8 g/mol
Molecular Formula C34H54N2
Exact Mass 490.4287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AraDodEKxse
Name Cholest-3-eno-[3,4-b]pyridine, 6'-pyrrolidin-1-yl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H54N2
InChI InChI=1S/C34H54N2/c1-23(2)9-8-10-24(3)27-14-15-28-25-11-13-29-26-12-16-32(36-21-6-7-22-36)35-31(26)18-20-34(29,5)30(25)17-19-33(27,28)4/h12,16,23-25,27-30H,6-11,13-15,17-22H2,1-5H3
InChIKey PVCCPDGFJCXWDE-UHFFFAOYSA-N
Molecular Weight 490.820 g/mol
SMILES C12C3(C(c4c(nc(N5CCCC5)cc4)CC3)CCC1C1C(C(C(C)CCCC(C)C)CC1)(CC2)C)C
SPLASH splash10-0006-8410900000-4703f3137b4bb1096165
Synonyms 9-(1,5-Dimethylhexyl)-6a,8a-dimethyl-3-(1-pyrrolidinyl)-6,6a,6b,7,8,8a,9,10,11,11a,11b,12,13,13a-tetradecahydro-5H-cyclopenta[5,6]naphtho[2,1-f]quinoline
Wiley ID 1474804