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1.beta.-methylamino-5.alpha.-cholestane
SpectraBase Compound ID LWeSGbr1MZK
InChI InChI=1S/C28H51N/c1-19(2)9-7-10-20(3)23-15-16-24-22-14-13-21-11-8-12-26(29-6)28(21,5)25(22)17-18-27(23,24)4/h19-26,29H,7-18H2,1-6H3/t20-,21-,22+,23-,24+,25+,26-,27-,28+/m1/s1
InChIKey LJCXLPPFBJRBFM-UIMIUJRLSA-N
Mol Weight 401.7 g/mol
Molecular Formula C28H51N
Exact Mass 401.402151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7r3livEJ07p
Name 1.beta.-methylamino-5.alpha.-cholestane
Alternate Name(s) N-[(1beta,5alpha)-cholestan-1-yl]-N-methylamine N-[(1beta,5alpha)-cholestan-1-yl]methanamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H51N
InChI InChI=1S/C28H51N/c1-19(2)9-7-10-20(3)23-15-16-24-22-14-13-21-11-8-12-26(29-6)28(21,5)25(22)17-18-27(23,24)4/h19-26,29H,7-18H2,1-6H3/t20-,21-,22+,23-,24+,25+,26-,27-,28+/m1/s1
InChIKey LJCXLPPFBJRBFM-UIMIUJRLSA-N
Molecular Weight 401.723 g/mol
SMILES N([C@]1([C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(CCC1)[H])[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])C)[H])C
SPLASH splash10-0kmi-9102300000-771f0844d834bc54271a
Source of Spectrum PL-1982-0-0
Wiley ID 1370105