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3-[(3E,7E)-3,7-Dimethyl-9-(phenylsulfanyl)-3,7-nonadienyl]-2,2-dimethyloxirane
SpectraBase Compound ID 3RIvtjFZnff
InChI InChI=1S/C21H30OS/c1-17(13-14-20-21(3,4)22-20)9-8-10-18(2)15-16-23-19-11-6-5-7-12-19/h5-7,9,11-12,15,20H,8,10,13-14,16H2,1-4H3/b17-9+,18-15+
InChIKey UZLZAAYPPROHJD-LMVCELQXSA-N
Mol Weight 330.53 g/mol
Molecular Formula C21H30OS
Exact Mass 330.201737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lkn2bZn4LC4
Name 3-[(3E,7E)-3,7-Dimethyl-9-(phenylsulfanyl)-3,7-nonadienyl]-2,2-dimethyloxirane
CAS Registry Number 74986-29-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30OS
InChI InChI=1S/C21H30OS/c1-17(13-14-20-21(3,4)22-20)9-8-10-18(2)15-16-23-19-11-6-5-7-12-19/h5-7,9,11-12,15,20H,8,10,13-14,16H2,1-4H3/b17-9+,18-15+
InChIKey UZLZAAYPPROHJD-LMVCELQXSA-N
Molecular Weight 330.530 g/mol
SMILES C1(C(C)(C)O1)CC\C(C)=C\CC\C(C)=C\CSc1ccccc1
SPLASH splash10-0536-9410000000-54cefe1fc4646c7bc8fd
Source of Spectrum J-45-4788-0
Synonyms 3-[(3E,7E)-3,7-dimethyl-9-(phenylthio)nona-3,7-dienyl]-2,2-dimethyl-oxirane 3-[(3E,7E)-3,7-dimethyl-9-phenylsulfanyl-nona-3,7-dienyl]-2,2-dimethyl-oxirane Oxirane, 2,2-dimethyl-3-[3,7-dimethyl-9-(phenylthio)-3,7-nonadienyl] 3-[(3E,7E)-3,7-dimethyl-9-(phenylthio)nona-3,7-dienyl]-2,2-dimethyloxirane
Wiley ID 1328168