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1,3-Benzodithiole, 2-[3-(3-methoxyphenyl)propylidene]-
SpectraBase Compound ID 29iOyvADZOn
InChI InChI=1S/C17H16OS2/c1-18-14-8-4-6-13(12-14)7-5-11-17-19-15-9-2-3-10-16(15)20-17/h2-4,6,8-12H,5,7H2,1H3
InChIKey JMFTTWKQEPZELG-UHFFFAOYSA-N
Mol Weight 300.43 g/mol
Molecular Formula C17H16OS2
Exact Mass 300.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H7lanla1uqf
Name 1,3-Benzodithiole, 2-[3-(3-methoxyphenyl)propylidene]-
CAS Registry Number 87543-09-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16OS2
InChI InChI=1S/C17H16OS2/c1-18-14-8-4-6-13(12-14)7-5-11-17-19-15-9-2-3-10-16(15)20-17/h2-4,6,8-12H,5,7H2,1H3
InChIKey JMFTTWKQEPZELG-UHFFFAOYSA-N
Molecular Weight 300.434 g/mol
SMILES C1(Sc2ccccc2S1)=CCCc1cc(OC)ccc1
SPLASH splash10-004l-4900000000-6536822849e27d334ede
Source of Spectrum J-55-5082-6
Synonyms 1-[4,4-(1,2-benzenediyldithio)but-3-enyl]-3-methoxy-benzene 2-[3-(3-methoxyphenyl)propylidene]-1,3-benzodithiole 3-[3-(1,3-benzodithiol-2-ylidene)propyl]phenyl methyl ether
Wiley ID 1302856