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2-Bromo-4-methyl-1-(3-thiophenylethynyl)benzene
SpectraBase Compound ID EkdKlLVPIeO
InChI InChI=1S/C13H9BrS/c1-10-2-4-12(13(14)8-10)5-3-11-6-7-15-9-11/h2,4,6-9H,1H3
InChIKey QGBIOYYTYIVXDY-UHFFFAOYSA-N
Mol Weight 277.18 g/mol
Molecular Formula C13H9BrS
Exact Mass 275.960834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrxIsNthgM2
Name 2-Bromo-4-methyl-1-(3-thiophenylethynyl)benzene
Alternate Name(s) 3-((2-bromo-4-methylphenyl)ethynyl)thiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9BrS
InChI InChI=1S/C13H9BrS/c1-10-2-4-12(13(14)8-10)5-3-11-6-7-15-9-11/h2,4,6-9H,1H3
InChIKey QGBIOYYTYIVXDY-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201970m
Molecular Weight 277.179 g/mol
SMILES c1cc(C#Cc2ccsc2)c(cc1C)Br
SPLASH splash10-0kdi-3490000000-b30d0dc9f0eeafe9b517
Source of Spectrum A1-13-5100/SMS5-1k
Wiley ID 1753713