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3-Chloro-2-(thiophene-2-carbonyl)-benzoic acid methyl ester
SpectraBase Compound ID GdySjfMfNQK
InChI InChI=1S/C13H9ClO3S/c1-17-13(16)8-4-2-5-9(14)11(8)12(15)10-6-3-7-18-10/h2-7H,1H3
InChIKey ZTKAQQNHGCNROR-UHFFFAOYSA-N
Mol Weight 280.73 g/mol
Molecular Formula C13H9ClO3S
Exact Mass 279.996093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8n6dRGGJ5v
Name 3-Chloro-2-(thiophene-2-carbonyl)-benzoic acid methyl ester
Alternate Name(s) Methyl 3-chloro-2-(thiophene-2-carbonyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9ClO3S
InChI InChI=1S/C13H9ClO3S/c1-17-13(16)8-4-2-5-9(14)11(8)12(15)10-6-3-7-18-10/h2-7H,1H3
InChIKey ZTKAQQNHGCNROR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201300049
Molecular Weight 280.725 g/mol
SMILES c1(C(=O)c2cccs2)c(cccc1Cl)C(=O)OC
SPLASH splash10-03dj-0970000000-e91a04cbd29caed25fe2
Source of Spectrum ASC-355-989/SM7-13c
Wiley ID 1762000