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

*Links on SpectraBase are not permalinks.
4.alpha.-dimethylamino-5.alpha.-cholestane
SpectraBase Compound ID CHGzuFT173K
InChI InChI=1S/C29H53N/c1-20(2)10-8-11-21(3)23-15-16-24-22-13-14-26-27(30(6)7)12-9-18-28(26,4)25(22)17-19-29(23,24)5/h20-27H,8-19H2,1-7H3/t21-,22+,23-,24+,25+,26+,27-,28-,29-/m1/s1
InChIKey XKMMRDYMRVSQFW-KCBFBPNVSA-N
Mol Weight 415.8 g/mol
Molecular Formula C29H53N
Exact Mass 415.417801 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 KGZEcM1qUCs
Name 4.alpha.-dimethylamino-5.alpha.-cholestane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H53N
InChI InChI=1S/C29H53N/c1-20(2)10-8-11-21(3)23-15-16-24-22-13-14-26-27(30(6)7)12-9-18-28(26,4)25(22)17-19-29(23,24)5/h20-27H,8-19H2,1-7H3/t21-,22+,23-,24+,25+,26+,27-,28-,29-/m1/s1
InChIKey XKMMRDYMRVSQFW-KCBFBPNVSA-N
Molecular Weight 415.750 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CCC[C@]4(N(C)C)[H])C)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C
SPLASH splash10-00lr-9000400000-0a6b92691b88e2686381
Source of Spectrum PL-1982-0-0
Synonyms N-[(4alpha,5alpha)-cholestan-4-yl]-N,N-dimethylamine N-[(4alpha,5alpha)-cholestan-4-yl]-N-methylmethanamine
Wiley ID 1376130