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m-(3-methyl-2-thioureido)benzoic acid, methyl ester
SpectraBase Compound ID BHiUP3c1vsc
InChI InChI=1S/C10H12N2O2S/c1-11-10(15)12-8-5-3-4-7(6-8)9(13)14-2/h3-6H,1-2H3,(H2,11,12,15)
InChIKey HFTKNODXKCMXOH-UHFFFAOYSA-N
Mol Weight 224.28 g/mol
Molecular Formula C10H12N2O2S
Exact Mass 224.061949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9So93GYWkQK
Name m-(3-METHYL-2-THIOUREIDO)BENZOIC ACID, METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12N2O2S
InChI InChI=1S/C10H12N2O2S/c1-11-10(15)12-8-5-3-4-7(6-8)9(13)14-2/h3-6H,1-2H3,(H2,11,12,15)
InChIKey HFTKNODXKCMXOH-UHFFFAOYSA-N
Melting Point 127-129C
Molecular Weight 224.28
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms BENZOIC ACID, m-(3-METHYL-2-THIOUREIDO)-, METHYL ESTER