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3-Ethenylcholestan-3-ol
SpectraBase Compound ID 166VqNTRDmN
InChI InChI=1S/C29H50O/c1-7-29(30)18-17-27(5)22(19-29)11-12-23-25-14-13-24(21(4)10-8-9-20(2)3)28(25,6)16-15-26(23)27/h7,20-26,30H,1,8-19H2,2-6H3
InChIKey AUBQGIIWQRESTG-UHFFFAOYSA-N
Mol Weight 414.7 g/mol
Molecular Formula C29H50O
Exact Mass 414.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTvT5fvD2Rf
Name 3-Ethenylcholestan-3-ol
Alternate Name(s) 17-(1,5-Dimethylhexyl)-10,13-dimethyl-3-vinylhexadecahydrocyclopenta[a]phenanthren-3-ol 17-(1,5-Dimethyl-hexyl)-10,13-dimethyl-3-vinyl-hexadecahydro-cyclopenta[a]phenan 1-(1,5-Dimethylhexyl)-9a,11a-dimethyl-7-vinylhexadecahydrocyclopenta[a]phenanthren-7-ol 17-(1,5-dimethylhexyl)-10,13-dimethyl-3-vinyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol 3-Ethenyl-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol 3-Vinylcholestan-3-ol
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Formula C29H50O
InChI InChI=1S/C29H50O/c1-7-29(30)18-17-27(5)22(19-29)11-12-23-25-14-13-24(21(4)10-8-9-20(2)3)28(25,6)16-15-26(23)27/h7,20-26,30H,1,8-19H2,2-6H3
InChIKey AUBQGIIWQRESTG-UHFFFAOYSA-N
Molecular Weight 414.718 g/mol
SMILES OC1(CC2C(C3CCC4(C(C3CC2)CCC4C(C)CCCC(C)C)C)(CC1)C)C=C
SPLASH splash10-0a5c-9841100000-cbdca2c78ab2f0797bcf
Source of Spectrum CM-1999-8380-0
Wiley ID 470734