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Cholest-5-en-3-ol, 23-ethylidene-, (3.beta.,23E)-
SpectraBase Compound ID 4ALBu4Kf5GK
InChI InChI=1S/C29H48O/c1-7-21(16-19(2)3)17-20(4)25-10-11-26-24-9-8-22-18-23(30)12-14-28(22,5)27(24)13-15-29(25,26)6/h7-8,19-20,23-27,30H,9-18H2,1-6H3/b21-7-/t20-,23?,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey HTLFPGUVQJEGPN-HRKULPSGSA-N
Mol Weight 412.7 g/mol
Molecular Formula C29H48O
Exact Mass 412.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AggDLlPTwIG
Name Cholest-5-en-3-ol, 23-ethylidene-, (3.beta.,23E)-
Alternate Name(s) 24-Methylene,25-homocholesterol (23Z/E)-23-Ethylidenecholesterol 23-ethylidenecholest-5-en-3-ol 24-Methylene-24-homocholesterol
CAS Registry Number 83511-94-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H48O
InChI InChI=1S/C29H48O/c1-7-21(16-19(2)3)17-20(4)25-10-11-26-24-9-8-22-18-23(30)12-14-28(22,5)27(24)13-15-29(25,26)6/h7-8,19-20,23-27,30H,9-18H2,1-6H3/b21-7-/t20-,23?,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey HTLFPGUVQJEGPN-HRKULPSGSA-N
Molecular Weight 412.702 g/mol
SMILES OC1CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](C\C(=C/C)CC(C)C)(C)[H])[H])[H])C)[H])C
SPLASH splash10-0udi-0059000000-cccb7815fef120161b10
Source of Spectrum C-104-6732-0
Wiley ID 1374751