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5.alpha.-Chol-20(22)-en-12-one
SpectraBase Compound ID 5j1iP5y8GrW
InChI InChI=1S/C24H38O/c1-5-8-16(2)19-12-13-20-18-11-10-17-9-6-7-14-23(17,3)21(18)15-22(25)24(19,20)4/h8,17-21H,5-7,9-15H2,1-4H3/b16-8+/t17-,18+,19-,20+,21+,23+,24-/m1/s1
InChIKey IHBHIRKVXJVVNA-WRCVKGJVSA-N
Mol Weight 342.6 g/mol
Molecular Formula C24H38O
Exact Mass 342.292266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FP35NdDaNTi
Name 5.alpha.-Chol-20(22)-en-12-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O
InChI InChI=1S/C24H38O/c1-5-8-16(2)19-12-13-20-18-11-10-17-9-6-7-14-23(17,3)21(18)15-22(25)24(19,20)4/h8,17-21H,5-7,9-15H2,1-4H3/b16-8+/t17-,18+,19-,20+,21+,23+,24-/m1/s1
InChIKey IHBHIRKVXJVVNA-WRCVKGJVSA-N
Molecular Weight 342.567 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@]([C@]3(CC2=O)[H])(C)CCCC4)[H])[H])(CC[C@@]1(\C(=C\CC)C)[H])[H])C
SPLASH splash10-0006-1109000000-7b17c2174ccce1529a7a
Source of Spectrum AN-90-160-0
Synonyms (5alpha,20E)-chol-20(22)-en-12-one
Wiley ID 1337062