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1.alpha.-amino-5.alpha.-cholestane
SpectraBase Compound ID 6FLAYU0R9aD
InChI InChI=1S/C27H49N/c1-18(2)8-6-9-19(3)22-14-15-23-21-13-12-20-10-7-11-25(28)27(20,5)24(21)16-17-26(22,23)4/h18-25H,6-17,28H2,1-5H3/t19-,20-,21+,22-,23+,24+,25+,26-,27+/m1/s1
InChIKey NMGUVCBQWZDNOG-PHKHAJRTSA-N
Mol Weight 387.7 g/mol
Molecular Formula C27H49N
Exact Mass 387.386501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0Ji9FBRCu8
Name 1.alpha.-amino-5.alpha.-cholestane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H49N
InChI InChI=1S/C27H49N/c1-18(2)8-6-9-19(3)22-14-15-23-21-13-12-20-10-7-11-25(28)27(20,5)24(21)16-17-26(22,23)4/h18-25H,6-17,28H2,1-5H3/t19-,20-,21+,22-,23+,24+,25+,26-,27+/m1/s1
InChIKey NMGUVCBQWZDNOG-PHKHAJRTSA-N
Molecular Weight 387.696 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]
SPLASH splash10-052r-9315000000-beaf9d46abec12696079
Source of Spectrum PL-1982-0-0
Synonyms (1alpha,5alpha)-cholestan-1-amine 4.alpha.-amino-5.alpha.-cholestane
Wiley ID 1363503