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5-(5-Chloro-2-hydroxy-benzoyl)-2-phenylsulfanyl-benzoic acid methyl ester
SpectraBase Compound ID 1A266YfYDYx
InChI InChI=1S/C21H15ClO4S/c1-26-21(25)17-11-13(20(24)16-12-14(22)8-9-18(16)23)7-10-19(17)27-15-5-3-2-4-6-15/h2-12,23H,1H3
InChIKey YWXSUCZVILBYNA-UHFFFAOYSA-N
Mol Weight 398.86 g/mol
Molecular Formula C21H15ClO4S
Exact Mass 398.037958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oqAlPrPb3R
Name 5-(5-Chloro-2-hydroxy-benzoyl)-2-phenylsulfanyl-benzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15ClO4S
InChI InChI=1S/C21H15ClO4S/c1-26-21(25)17-11-13(20(24)16-12-14(22)8-9-18(16)23)7-10-19(17)27-15-5-3-2-4-6-15/h2-12,23H,1H3
InChIKey YWXSUCZVILBYNA-UHFFFAOYSA-N
Molecular Weight 398.860 g/mol
SMILES Oc1c(C(c2cc(c(Sc3ccccc3)cc2)C(=O)OC)=O)cc(cc1)Cl
SPLASH splash10-0002-0219200000-ac9f9f3fd3410d5d4d67
Source of Spectrum F-65-7572-10
Synonyms Methyl 5-(2-hydroxy-5-chlorobenzoyl)-2-(thiophenoxy)benzoate
Wiley ID 1680400