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25-(1-methylethenyl)-23-vinylcholest-5-en-3.beta.-ol A
SpectraBase Compound ID 5ciJXBIj6cZ
InChI InChI=1S/C32H52O/c1-9-23(20-30(5,6)21(2)3)18-22(4)27-12-13-28-26-11-10-24-19-25(33)14-16-31(24,7)29(26)15-17-32(27,28)8/h9-10,22-23,25-29,33H,1-2,11-20H2,3-8H3/t22-,23?,25+,26?,27-,28?,29?,31+,32-/m1/s1
InChIKey KIAQSEJFHYPKDB-AUPIBLCYSA-N
Mol Weight 452.8 g/mol
Molecular Formula C32H52O
Exact Mass 452.401816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hv93IL9FY60
Name 25-(1-methylethenyl)-23-vinylcholest-5-en-3.beta.-ol A
Alternate Name(s) (2R,5S,14R,15R)-14-[(2R)-4-ethenyl-6,6,7-trimethyloct-7-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-ol
CAS Registry Number 119879-69-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H52O
InChI InChI=1S/C32H52O/c1-9-23(20-30(5,6)21(2)3)18-22(4)27-12-13-28-26-11-10-24-19-25(33)14-16-31(24,7)29(26)15-17-32(27,28)8/h9-10,22-23,25-29,33H,1-2,11-20H2,3-8H3/t22-,23?,25+,26?,27-,28?,29?,31+,32-/m1/s1
InChIKey KIAQSEJFHYPKDB-AUPIBLCYSA-N
Molecular Weight 452.767 g/mol
SMILES O[C@]1(CC[C@@]2(C3CC[C@]4(C(C3CC=C2C1)CC[C@@]4([C@@](CC(CC(C(=C)C)(C)C)C=C)(C)[H])[H])C)C)[H]
SPLASH splash10-05o0-9100000000-a8a95189856830f820b4
Source of Spectrum J-54-2124-72
Wiley ID 1388432