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1-Methyl-4-[(E)-3-phenyl-2-(phenylthio)allyl]benzene
SpectraBase Compound ID BRVS1beFtwk
InChI InChI=1S/C22H20S/c1-18-12-14-20(15-13-18)17-22(16-19-8-4-2-5-9-19)23-21-10-6-3-7-11-21/h2-16H,17H2,1H3/b22-16+
InChIKey ATAIBKNKDLNJEQ-CJLVFECKSA-N
Mol Weight 316.46 g/mol
Molecular Formula C22H20S
Exact Mass 316.128572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1kM26b401Q
Name 1-Methyl-4-[(E)-3-phenyl-2-(phenylthio)allyl]benzene
Alternate Name(s) 1-Methyl-4-[(E)-3-phenyl-2-(phenylthio)prop-2-enyl]benzene 1-Methyl-4-[(E)-3-phenyl-2-phenylsulfanyl-allyl]benzene 1-Methyl-4-[(E)-3-phenyl-2-phenylsulfanyl-prop-2-enyl]benzene
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Formula C22H20S
InChI InChI=1S/C22H20S/c1-18-12-14-20(15-13-18)17-22(16-19-8-4-2-5-9-19)23-21-10-6-3-7-11-21/h2-16H,17H2,1H3/b22-16+
InChIKey ATAIBKNKDLNJEQ-CJLVFECKSA-N
Molecular Weight 316.462 g/mol
SMILES c1(\C=C/(Sc2ccccc2)Cc2ccc(cc2)C)ccccc1
SPLASH splash10-066r-4396000000-555f0334ba10ce27f0a8
Source of Spectrum F7-15-62-4
Wiley ID 1556820