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4,4-Dimethylcholesta-5,7,9(11)-trien-3-ol
SpectraBase Compound ID 6OUPNLrVIfQ
InChI InChI=1S/C29H46O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h11,14-15,19-20,22-23,26,30H,8-10,12-13,16-18H2,1-7H3
InChIKey JSJROSGORQZUFJ-UHFFFAOYSA-N
Mol Weight 410.7 g/mol
Molecular Formula C29H46O
Exact Mass 410.354866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HsZZuMLnqTf
Name 4,4-Dimethylcholesta-5,7,9(11)-trien-3-ol
Alternate Name(s) 17-(1,5-dimethylhexyl)-4,4,10,13-tetramethyl-1,2,3,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-ol 4,4,10,13-tetramethyl-17-(6-methylheptan-2-yl)-1,2,3,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-ol Cholesta-5,7,9(11)-trien-3-ol, 4,4-dimethyl-, (3.beta.)-
CAS Registry Number 53296-72-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H46O
InChI InChI=1S/C29H46O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h11,14-15,19-20,22-23,26,30H,8-10,12-13,16-18H2,1-7H3
InChIKey JSJROSGORQZUFJ-UHFFFAOYSA-N
Molecular Weight 410.686 g/mol
SMILES OC1CCC2(C(C1(C)C)=CC=C1C2=CCC2(C1CCC2C(CCCC(C)C)C)C)C
SPLASH splash10-0a4l-5963000000-9210f336b2358f333837
Source of Spectrum W5-0-0-0
Wiley ID 1373907