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21-nor-5.alpha.-Cholestan-3.beta.-ol
SpectraBase Compound ID 96EfWqa3STu
InChI InChI=1S/C26H46O/c1-18(2)7-5-6-8-19-10-12-23-22-11-9-20-17-21(27)13-15-26(20,4)24(22)14-16-25(19,23)3/h18-24,27H,5-17H2,1-4H3/t19-,20-,21-,22-,23-,24-,25+,26-/m0/s1
InChIKey ISSPUGFLYZFENZ-UONNWJQASA-N
Mol Weight 374.7 g/mol
Molecular Formula C26H46O
Exact Mass 374.354866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7nPbjlnf9iZ
Name 21-nor-5.alpha.-Cholestan-3.beta.-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H46O
InChI InChI=1S/C26H46O/c1-18(2)7-5-6-8-19-10-12-23-22-11-9-20-17-21(27)13-15-26(20,4)24(22)14-16-25(19,23)3/h18-24,27H,5-17H2,1-4H3/t19-,20-,21-,22-,23-,24-,25+,26-/m0/s1
InChIKey ISSPUGFLYZFENZ-UONNWJQASA-N
Molecular Weight 374.653 g/mol
SMILES O[C@]1(CC[C@@]2([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)(CCCCC(C)C)[H])[H])([H])CC[C@]2(C1)[H])[H])C)[H]
SPLASH splash10-0089-0096000000-1fcf8ff7c578a275c324
Source of Spectrum F5-7-2308-5
Wiley ID 1696547