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

*Links on SpectraBase are not permalinks.
6-Aza-A-nor-B,B-dihomo-5.beta.-cholestan-7-one
SpectraBase Compound ID 22rscyIfruu
InChI InChI=1S/C27H47NO/c1-18(2)8-6-9-19(3)21-12-13-22-20-11-14-25(29)28-24-10-7-16-27(24,5)23(20)15-17-26(21,22)4/h18-24H,6-17H2,1-5H3,(H,28,29)/t19-,20+,21-,22+,23+,24-,26-,27-/m1/s1
InChIKey LABSDSTWBWMTNF-GRFPRMRASA-N
Mol Weight 401.7 g/mol
Molecular Formula C27H47NO
Exact Mass 401.365765 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 4oqKMKOgPpp
Name 6-Aza-A-nor-B,B-dihomo-5.beta.-cholestan-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H47NO
InChI InChI=1S/C27H47NO/c1-18(2)8-6-9-19(3)21-12-13-22-20-11-14-25(29)28-24-10-7-16-27(24,5)23(20)15-17-26(21,22)4/h18-24H,6-17H2,1-5H3,(H,28,29)/t19-,20+,21-,22+,23+,24-,26-,27-/m1/s1
InChIKey LABSDSTWBWMTNF-GRFPRMRASA-N
Molecular Weight 401.679 g/mol
SMILES N1C(CC[C@]2([C@]3([C@](CC[C@@]2([C@@]2([C@]1(CCC2)[H])C)[H])([C@](CC3)([C@@](CCCC(C)C)(C)[H])[H])C)[H])[H])=O
SPLASH splash10-01b9-9201000000-2d8601132134f889b5ff
Source of Spectrum KC-1982-938-0
Synonyms (1R,3aS,3bS,7aR,10aR,10bS,12aR)-1-[(1R)-1,5-dimethylhexyl]-10a,12a-dimethylhexadecahydrocyclopenta[b]indeno[5,4-d]azocin-6(1H)-one
Wiley ID 1370087