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3-(2-Phenylethynyl)thiophene
SpectraBase Compound ID VK9SvQrxFO
InChI InChI=1S/C12H8S/c1-2-4-11(5-3-1)6-7-12-8-9-13-10-12/h1-5,8-10H
InChIKey CVWNFWSBDGLRPO-UHFFFAOYSA-N
Mol Weight 184.26 g/mol
Molecular Formula C12H8S
Exact Mass 184.034671 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKuWkHcb3zz
Name 3-(2-Phenylethynyl)thiophene
Alternate Name(s) 3-(Phenylethynyl)-thiophene 1-Phenyl-2-(2-thienyl)acetylene 3-(Phenylethynyl)thiophene 1-Phenyl-2-(3-thienyl)acetylene 2-(2-Phenylethynyl)thiophene 2-(Phenylethynyl)thiophene
Comments Less than 3 mono-isotopic peaks
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Formula C12H8S
InChI InChI=1S/C12H8S/c1-2-4-11(5-3-1)6-7-12-8-9-13-10-12/h1-5,8-10H
InChIKey CVWNFWSBDGLRPO-UHFFFAOYSA-N
Molecular Weight 184.256 g/mol
SMILES C(#Cc1ccccc1)c1cscc1
SPLASH splash10-001i-0900000000-4121328fed501bbf461a
Source of Spectrum QB-21-345-3
Wiley ID 860493