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Benzene, [[3-[(2-methyl-2-propenyl)oxy]-1-propenyl]thio]-, (E)-
SpectraBase Compound ID JmdKfIIDG0n
InChI InChI=1S/C13H16OS/c1-12(2)11-14-9-6-10-15-13-7-4-3-5-8-13/h3-8,10H,1,9,11H2,2H3/b10-6+
InChIKey CNRDFTRJZVWJFU-UXBLZVDNSA-N
Mol Weight 220.33 g/mol
Molecular Formula C13H16OS
Exact Mass 220.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8xRXrvTFQSK
Name Benzene, [[3-[(2-methyl-2-propenyl)oxy]-1-propenyl]thio]-, (E)-
Alternate Name(s) ({(1E)-3-[(2-methyl-2-propenyl)oxy]-1-propenyl}sulfanyl)benzene 2-Methyl-2-propenyl (2E)-3-(phenylsulfanyl)-2-propenyl ether trans-6-methyl-1-phenylthio-4-oxahept-1,6-diene
CAS Registry Number 108788-79-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16OS
InChI InChI=1S/C13H16OS/c1-12(2)11-14-9-6-10-15-13-7-4-3-5-8-13/h3-8,10H,1,9,11H2,2H3/b10-6+
InChIKey CNRDFTRJZVWJFU-UXBLZVDNSA-N
Molecular Weight 220.330 g/mol
SMILES c1(S\C=C\COCC(=C)C)ccccc1
SPLASH splash10-0a4i-9600000000-8334cca2203eb5e3bb98
Source of Spectrum AJ-60-671-9
Wiley ID 1219843