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Cholestan-3-one, cyclic 1,2-ethanediyl acetal, (5.alpha.)-
SpectraBase Compound ID 2Q9HfQBfKBu
InChI InChI=1S/C29H50O2/c1-20(2)7-6-8-21(3)24-11-12-25-23-10-9-22-19-29(30-17-18-31-29)16-15-27(22,4)26(23)13-14-28(24,25)5/h20-26H,6-19H2,1-5H3
InChIKey NCAQEOULCQQMGY-UHFFFAOYSA-N
Mol Weight 430.7 g/mol
Molecular Formula C29H50O2
Exact Mass 430.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNWt1gI9Yqq
Name Cholestan-3-one, cyclic 1,2-ethanediyl acetal, (5.alpha.)-
CAS Registry Number 1858-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H50O2
InChI InChI=1S/C29H50O2/c1-20(2)7-6-8-21(3)24-11-12-25-23-10-9-22-19-29(30-17-18-31-29)16-15-27(22,4)26(23)13-14-28(24,25)5/h20-26H,6-19H2,1-5H3
InChIKey NCAQEOULCQQMGY-UHFFFAOYSA-N
Molecular Weight 430.717 g/mol
SMILES CC(C)CCCC(C)C1CCC2C1(CCC1C2CCC2C1(CCC1(C2)OCCO1)C)C
SPLASH splash10-0002-9400100000-ac2bdde72b257bbd0ba3
Source of Spectrum AD-0-3925-0
Synonyms 10,13-dimethyl-17-(6-methylheptan-2-yl)spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane] 17-(1,5-dimethylhexyl)-10,13-dimethyl-spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane] Cholestan-3-one, cyclic 1,2-ethanediyl aetal, (5.beta.)- 5.beta.-Cholestan-3-one, cyclic ethylene acetal
Wiley ID 59513