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3-Chloro-2-(4-methylphenyl)-6-methylbenzo[b]thiophene
SpectraBase Compound ID J7Sh320gh6N
InChI InChI=1S/C16H13ClS/c1-10-3-6-12(7-4-10)16-15(17)13-8-5-11(2)9-14(13)18-16/h3-9H,1-2H3
InChIKey AYNLKGNENXEVJK-UHFFFAOYSA-N
Mol Weight 272.79 g/mol
Molecular Formula C16H13ClS
Exact Mass 272.042649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZus3rFVMRa
Name 3-Chloro-2-(4-methylphenyl)-6-methylbenzo[b]thiophene
Alternate Name(s) 3-Chloro-6-methyl-2-(4-methylphenyl)-1-benzothiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClS
InChI InChI=1S/C16H13ClS/c1-10-3-6-12(7-4-10)16-15(17)13-8-5-11(2)9-14(13)18-16/h3-9H,1-2H3
InChIKey AYNLKGNENXEVJK-UHFFFAOYSA-N
Molecular Weight 272.793 g/mol
SMILES c12c(c(c(s2)-c2ccc(cc2)C)Cl)ccc(c1)C
SPLASH splash10-00di-0090000000-d1ddef9944f2f8fa37a8
Source of Spectrum SO-0-524-6
Wiley ID 1544887