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(E)-5-Cyclododecylidene-2-methyl-3-(phenylthio)-3-penten-2-ol
SpectraBase Compound ID 63Gadma0ryM
InChI InChI=1S/C24H36OS/c1-24(2,25)23(26-22-17-13-10-14-18-22)20-19-21-15-11-8-6-4-3-5-7-9-12-16-21/h10,13-14,17-20,25H,3-9,11-12,15-16H2,1-2H3/b23-20+
InChIKey LLKKYRUGZXJLKK-BSYVCWPDSA-N
Mol Weight 372.6 g/mol
Molecular Formula C24H36OS
Exact Mass 372.248687 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6QyTaGEqZid
Name (E)-5-Cyclododecylidene-2-methyl-3-(phenylthio)-3-penten-2-ol
CAS Registry Number 88904-74-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36OS
InChI InChI=1S/C24H36OS/c1-24(2,25)23(26-22-17-13-10-14-18-22)20-19-21-15-11-8-6-4-3-5-7-9-12-16-21/h10,13-14,17-20,25H,3-9,11-12,15-16H2,1-2H3/b23-20+
InChIKey LLKKYRUGZXJLKK-BSYVCWPDSA-N
Molecular Weight 372.611 g/mol
SMILES OC(\C(=C/C=C1CCCCCCCCCCC1)Sc1ccccc1)(C)C
SPLASH splash10-0pc0-9318000000-3ab3d995eb22a3c65e86
Source of Spectrum J-49-1089-0
Synonyms (3E)-5-cyclododecylidene-2-methyl-3-(phenylsulfanyl)-3-penten-2-ol
Wiley ID 1355813