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Cholestane, 3-ethoxy-, (3.beta.,5.alpha.)-
SpectraBase Compound ID WknXKEz2GK
InChI InChI=1S/C29H52O/c1-7-30-23-15-17-28(5)22(19-23)11-12-24-26-14-13-25(21(4)10-8-9-20(2)3)29(26,6)18-16-27(24)28/h20-27H,7-19H2,1-6H3
InChIKey WDVKALNTNPKVON-UHFFFAOYSA-N
Mol Weight 416.7 g/mol
Molecular Formula C29H52O
Exact Mass 416.401816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCni5Yy2ylA
Name Cholestane, 3-ethoxy-, (3.beta.,5.alpha.)-
CAS Registry Number 2089-02-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H52O
InChI InChI=1S/C29H52O/c1-7-30-23-15-17-28(5)22(19-23)11-12-24-26-14-13-25(21(4)10-8-9-20(2)3)29(26,6)18-16-27(24)28/h20-27H,7-19H2,1-6H3
InChIKey WDVKALNTNPKVON-UHFFFAOYSA-N
Molecular Weight 416.734 g/mol
SMILES CC12C(C3C(CC2)C2(C)C(CC3)CC(CC2)OCC)CCC1C(CCCC(C)C)C
SPLASH splash10-0aor-8930000000-b056f9c973e9ec07cd6e
Source of Spectrum OS-6-44-0
Synonyms 3-Ethoxycholestane 17-(1,5-dimethylhexyl)-3-ethoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene 3-Ethoxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene Cholestane, 3.beta.-ethoxy-
Wiley ID 1376696