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(E)-methyl 6,10-dimethyl-2-(phenylthio)-5,9-undecadienoate
SpectraBase Compound ID KRJnqyUPKKE
InChI InChI=1S/C20H28O2S/c1-16(2)10-8-11-17(3)12-9-15-19(20(21)22-4)23-18-13-6-5-7-14-18/h5-7,10,12-14,19H,8-9,11,15H2,1-4H3/b17-12+
InChIKey GFYDXOURUOAZRB-SFQUDFHCSA-N
Mol Weight 332.5 g/mol
Molecular Formula C20H28O2S
Exact Mass 332.181001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ExisAt7sptT
Name (E)-methyl 6,10-dimethyl-2-(phenylthio)-5,9-undecadienoate
Alternate Name(s) Methyl (5E)-6,10-dimethyl-2-(phenylsulfanyl)-5,9-undecadienoate Methyl (5E)-6,10-dimethyl-2-phenylsulfanylundeca-5,9-dienoate Methyl (5E)-6,10-dimethyl-2-phenylsulfanyl-undeca-5,9-dienoate
CAS Registry Number 71841-09-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2S
InChI InChI=1S/C20H28O2S/c1-16(2)10-8-11-17(3)12-9-15-19(20(21)22-4)23-18-13-6-5-7-14-18/h5-7,10,12-14,19H,8-9,11,15H2,1-4H3/b17-12+
InChIKey GFYDXOURUOAZRB-SFQUDFHCSA-N
Molecular Weight 332.502 g/mol
SMILES C(C(Sc1ccccc1)CC\C=C\(CCC=C(C)C)C)(=O)OC
SPLASH splash10-066r-9510000000-19625d9b876b2aa09e5a
Source of Spectrum J-45-3551-0
Wiley ID 1329560