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3.alpha.-methylamino-3.beta.-methylcholestane
SpectraBase Compound ID J3x8n8sGh0o
InChI InChI=1S/C29H53N/c1-20(2)9-8-10-21(3)24-13-14-25-23-12-11-22-19-27(4,30-7)17-18-28(22,5)26(23)15-16-29(24,25)6/h20-26,30H,8-19H2,1-7H3/t21-,22?,23+,24-,25+,26+,27-,28+,29-/m1/s1
InChIKey GCYSENKADSGLLX-CGOIVBCVSA-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 DHCKfmOxGRo
Name 3.alpha.-methylamino-3.beta.-methylcholestane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H53N
InChI InChI=1S/C29H53N/c1-20(2)9-8-10-21(3)24-13-14-25-23-12-11-22-19-27(4,30-7)17-18-28(22,5)26(23)15-16-29(24,25)6/h20-26,30H,8-19H2,1-7H3/t21-,22?,23+,24-,25+,26+,27-,28+,29-/m1/s1
InChIKey GCYSENKADSGLLX-CGOIVBCVSA-N
Molecular Weight 415.750 g/mol
SMILES N([C@@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CCC2C1)[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])C)C)C
SPLASH splash10-001i-9100300000-ebfa08065d1265329b7c
Source of Spectrum PL-1982-0-0
Synonyms N-methyl-N-[(3alpha)-3-methylcholestan-3-yl]amine N-[(3alpha)-3-methylcholestan-3-yl]methanamine
Wiley ID 1376132