For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5.alpha.-Cholest-7,24-diene-3,6-dione
SpectraBase Compound ID DDHuv20TKtd
InChI InChI=1S/C27H40O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h7,16,18,21-24H,6,8-15H2,1-5H3/t18-,21-,22+,23+,24-,26-,27-/m1/s1
InChIKey GHPZVEJGBCWHPR-RAGSFNKYSA-N
Mol Weight 396.6 g/mol
Molecular Formula C27H40O2
Exact Mass 396.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EJ1QUV3nHKJ
Name 5.alpha.-Cholest-7,24-diene-3,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40O2
InChI InChI=1S/C27H40O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h7,16,18,21-24H,6,8-15H2,1-5H3/t18-,21-,22+,23+,24-,26-,27-/m1/s1
InChIKey GHPZVEJGBCWHPR-RAGSFNKYSA-N
Molecular Weight 396.615 g/mol
SMILES C1(CC[C@]2([C@](C1)(C(C=C1[C@@]3(CC[C@]([C@@](CCC=C(C)C)(C)[H])([C@@]3(C)CC[C@]21[H])[H])[H])=O)[H])C)=O
SPLASH splash10-0532-0089000000-0c8048b7c9ead57310b2
Source of Spectrum X2-49-783-4
Synonyms (5alpha)-cholesta-7,24-diene-3,6-dione
Wiley ID 1601999