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6-Oxacholestane, (5.alpha.)-
SpectraBase Compound ID 7C9VJ3mPWiH
InChI InChI=1S/C26H46O/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-27-24-11-6-7-15-26(24,5)23(20)14-16-25(21,22)4/h18-24H,6-17H2,1-5H3/t19-,20+,21-,22+,23+,24+,25-,26-/m1/s1
InChIKey NCCPJAMPQAFNQJ-RISHNNBLSA-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 5lusYmtFjYE
Name 6-Oxacholestane, (5.alpha.)-
Alternate Name(s) Benz[b]indeno[5,4-d]pyran, 6-oxacholestane deriv. (1R,3aS,3bS,5aS,9aR,9bS,11aR)-1-[(1R)-1,5-dimethylhexyl]-9a,11a-dimethylhexadecahydroindeno[4,5-c]chromene 6-Oxa-5.alpha.-cholestane
CAS Registry Number 93920-67-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H46O
InChI InChI=1S/C26H46O/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-27-24-11-6-7-15-26(24,5)23(20)14-16-25(21,22)4/h18-24H,6-17H2,1-5H3/t19-,20+,21-,22+,23+,24+,25-,26-/m1/s1
InChIKey NCCPJAMPQAFNQJ-RISHNNBLSA-N
Molecular Weight 374.653 g/mol
SMILES [C@@]12([C@]([C@@]3(CO[C@@]4([C@]([C@]3(CC2)[H])(C)CCCC4)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C
SPLASH splash10-014i-0193000000-207b023e629d468fcaf8
Source of Spectrum J-50-2492-16
Wiley ID 1357000