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Furane-2-thiocarboxylic acid, 5-(2-phenylethynyl)-, S-(4-methylphenyl) ester
SpectraBase Compound ID 4M1QRRYJFDX
InChI InChI=1S/C20H14O2S/c1-15-7-12-18(13-8-15)23-20(21)19-14-11-17(22-19)10-9-16-5-3-2-4-6-16/h2-8,11-14H,1H3
InChIKey OCBBDVXWMPNILE-UHFFFAOYSA-N
Mol Weight 318.39 g/mol
Molecular Formula C20H14O2S
Exact Mass 318.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwfI40EyiJx
Name Furane-2-thiocarboxylic acid, 5-(2-phenylethynyl)-, S-(4-methylphenyl) ester
Alternate Name(s) 5-(2-phenylethynyl)-2-furancarbothioic acid S-(4-methylphenyl) ester 5-(2-phenylethynyl)furan-2-carbothioic acid S-(p-tolyl) ester S-(4-methylphenyl) 5-(2-phenylethynyl)furan-2-carbothioate S-(4-Methylphenyl) 5-(phenylethynyl)-2-furancarbothioate S-(p-tolyl) 5-(2-phenylethynyl)furan-2-carbothioate
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Formula C20H14O2S
InChI InChI=1S/C20H14O2S/c1-15-7-12-18(13-8-15)23-20(21)19-14-11-17(22-19)10-9-16-5-3-2-4-6-16/h2-8,11-14H,1H3
InChIKey OCBBDVXWMPNILE-UHFFFAOYSA-N
Molecular Weight 318.390 g/mol
SMILES c1(C(Sc2ccc(cc2)C)=O)oc(C#Cc2ccccc2)cc1
SPLASH splash10-000b-3900000000-b69173460ab3aabd6b01
Source of Spectrum AD-0-2532-0
Wiley ID 1433981