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m-[3-(2-thenoyl)-2-thioureido]benzoic acid, methyl ester

View entire compound with spectra: 3 NMR, and 1 FTIR

m-[3-(2-thenoyl)-2-thioureido]benzoic acid, methyl ester
SpectraBase Compound ID 3lzYevcCq6
InChI InChI=1S/C14H12N2O3S2/c1-19-13(18)9-4-2-5-10(8-9)15-14(20)16-12(17)11-6-3-7-21-11/h2-8H,1H3,(H2,15,16,17,20)
InChIKey GXOUBLOGWVCJCB-UHFFFAOYSA-N
Mol Weight 320.38 g/mol
Molecular Formula C14H12N2O3S2
Exact Mass 320.028935 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9XPaeAK1BB9
Name m-[3-(2-THENOYL)-2-THIOUREIDO]BENZOIC ACID, METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N2O3S2
InChI InChI=1S/C14H12N2O3S2/c1-19-13(18)9-4-2-5-10(8-9)15-14(20)16-12(17)11-6-3-7-21-11/h2-8H,1H3,(H2,15,16,17,20)
InChIKey GXOUBLOGWVCJCB-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 163-164C
Molecular Weight 320.39
Solvent DMSO-d6; Reference=TMS; Temperature 297K