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6-[(3-chlorobenzo[b]thien-2-yl)carboxamido]-m-toluic acid, ethyl ester
SpectraBase Compound ID 3WWS2aoxZbm
InChI InChI=1S/C19H16ClNO3S/c1-3-24-19(23)13-10-11(2)8-9-14(13)21-18(22)17-16(20)12-6-4-5-7-15(12)25-17/h4-10H,3H2,1-2H3,(H,21,22)
InChIKey RFFQGFQQCXZIJZ-UHFFFAOYSA-N
Mol Weight 373.85 g/mol
Molecular Formula C19H16ClNO3S
Exact Mass 373.053942 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BajeC9QyDsW
Name 6-[(3-CHLOROBENZO[b]THIEN-2-YL)CARBOXAMIDO]-m-TOLUIC ACID, ETHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16ClNO3S
InChI InChI=1S/C19H16ClNO3S/c1-3-24-19(23)13-10-11(2)8-9-14(13)21-18(22)17-16(20)12-6-4-5-7-15(12)25-17/h4-10H,3H2,1-2H3,(H,21,22)
InChIKey RFFQGFQQCXZIJZ-UHFFFAOYSA-N
Melting Point 154-156C
Molecular Weight 373.86
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms M-TOLUIC ACID, 6-//3-CHLOROBENZO/B/THIEN-2-YL/CARBOXAMIDO/-, ETHYL ESTER