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3-(Phenylthio)-2-[(3',4'-methylenedioxy)phenyl]-1,3-butadiene
SpectraBase Compound ID InCCv5colEr
InChI InChI=1S/C17H14O2S/c1-12(13(2)20-15-6-4-3-5-7-15)14-8-9-16-17(10-14)19-11-18-16/h3-10H,1-2,11H2
InChIKey TVRWOVLXVLEJFA-UHFFFAOYSA-N
Mol Weight 282.36 g/mol
Molecular Formula C17H14O2S
Exact Mass 282.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qhPdJ5bYb8
Name 3-(Phenylthio)-2-[(3',4'-methylenedioxy)phenyl]-1,3-butadiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O2S
InChI InChI=1S/C17H14O2S/c1-12(13(2)20-15-6-4-3-5-7-15)14-8-9-16-17(10-14)19-11-18-16/h3-10H,1-2,11H2
InChIKey TVRWOVLXVLEJFA-UHFFFAOYSA-N
Molecular Weight 282.357 g/mol
SMILES C(C(c1cc2c(OCO2)cc1)=C)(Sc1ccccc1)=C
SPLASH splash10-00e9-3920000000-33d9a70945cd066596a3
Source of Spectrum SK-22-2284-7
Synonyms (1Z)-2-(1,3-benzodioxol-5-yl)-1,3-butadienyl phenyl sulfide 1-(Phenylthio)-2-[(3',4'-methylenedioxy)phenyl]-1,3-butadiene 5-{(1Z)-1-[(phenylsulfanyl)methylene]-2-propenyl}-1,3-benzodioxole 5-[3-(phenylthio)buta-1,3-dien-2-yl]-1,3-benzodioxole 5-(1-Methylene-2-phenylsulfanyl-allyl)-1,3-benzodioxole 5-(3-phenylsulfanylbuta-1,3-dien-2-yl)-1,3-benzodioxole
Wiley ID 852161