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4-.alpha.-methylcholest-8(14)-en-3-.beta

View entire compound with spectra: 3 MS (GC)

4-.alpha.-methylcholest-8(14)-en-3-.beta
SpectraBase Compound ID GTUnPjbqJFm
InChI InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h18-20,22-23,25-26,29H,7-17H2,1-6H3/t19-,20+,22-,23?,25+,26+,27-,28+/m1/s1
InChIKey UIPYFONRKZTOIY-ASTPPUTISA-N
Mol Weight 400.7 g/mol
Molecular Formula C28H48O
Exact Mass 400.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dl1TjBGxddN
Name 4-.alpha.-methylcholest-8(14)-en-3-.beta
Alternate Name(s) (3beta,4alpha)-4-methylcholest-8(14)-en-3-ol 4-.alpha.-methylcholest-8(14)-en-3-..beta.-ol 4.alpha.-Methyl-5.alpha.-cholest-8-en-3.beta.-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H48O
InChI InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h18-20,22-23,25-26,29H,7-17H2,1-6H3/t19-,20+,22-,23?,25+,26+,27-,28+/m1/s1
InChIKey UIPYFONRKZTOIY-ASTPPUTISA-N
Molecular Weight 400.691 g/mol
SMILES O[C@@]1([C@](C2CCC3=C4[C@@]([C@@]([C@@](CCCC(C)C)(C)[H])(CC4)[H])(CC[C@@]3([C@]2(CC1)C)[H])C)(C)[H])[H]
SPLASH splash10-0udi-5921400000-7b17ccab569cf6d61738
Source of Spectrum SD-1992-0-0
Wiley ID 1369811