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(20S)-20-Iso-5.alpha.-cholestan-3.beta.-ol
SpectraBase Compound ID GIAjfKKC8fb
InChI InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20-,21-,22-,23?,24?,25?,26-,27+/m0/s1
InChIKey QYIXCDOBOSTCEI-QDCAVZQLSA-N
Mol Weight 388.7 g/mol
Molecular Formula C27H48O
Exact Mass 388.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H1iOpDOHFbV
Name (20S)-20-Iso-5.alpha.-cholestan-3.beta.-ol
Alternate Name(s) (3beta,5alpha,20S)-cholestan-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H48O
InChI InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20-,21-,22-,23?,24?,25?,26-,27+/m0/s1
InChIKey QYIXCDOBOSTCEI-QDCAVZQLSA-N
Molecular Weight 388.680 g/mol
SMILES O[C@]1(CC[C@@]2(C3CC[C@]4(C([C@@]3(CC[C@]2(C1)[H])[H])CCC4[C@](CCCC(C)C)(C)[H])C)C)[H]
SPLASH splash10-0159-0091000000-8d40bac3fb3ab6164198
Source of Spectrum C-114-316-0
Wiley ID 1364196