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1.alpha.-Dimethylamino-5.alpha.-cholestane

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1.alpha.-Dimethylamino-5.alpha.-cholestane
SpectraBase Compound ID AcsAezljTMk
InChI InChI=1S/C29H53N/c1-20(2)10-8-11-21(3)24-16-17-25-23-15-14-22-12-9-13-27(30(6)7)29(22,5)26(23)18-19-28(24,25)4/h20-27H,8-19H2,1-7H3/t21-,22-,23+,24-,25+,26+,27+,28-,29+/m1/s1
InChIKey KJHWWFXBJSNXFJ-KZBNDFJCSA-N
Mol Weight 415.8 g/mol
Molecular Formula C29H53N
Exact Mass 415.417801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uCYahs61fX
Name 1.alpha.-dimethylamino-5.alpha.-cholestane
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H53N
InChI InChI=1S/C29H53N/c1-20(2)10-8-11-21(3)24-16-17-25-23-15-14-22-12-9-13-27(30(6)7)29(22,5)26(23)18-19-28(24,25)4/h20-27H,8-19H2,1-7H3/t21-,22-,23+,24-,25+,26+,27+,28-,29+/m1/s1
InChIKey KJHWWFXBJSNXFJ-KZBNDFJCSA-N
Molecular Weight 415.750 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])([C@@](N(C)C)(CCC4)[H])C)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C
SPLASH splash10-05o0-9000200000-960c6634dd6bb0cb544d
Source of Spectrum PL-1982-0-0
Synonyms N-[(1alpha,5alpha)-cholestan-1-yl]-N,N-dimethylamine N-[(1alpha,5alpha)-cholestan-1-yl]-N-methylmethanamine
Wiley ID 1376126