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m-[3-(p-tert-butylbenzoyl)-2-thioureido]benzoic acid, methyl ester
SpectraBase Compound ID Alt3MShG8QW
InChI InChI=1S/C20H22N2O3S/c1-20(2,3)15-10-8-13(9-11-15)17(23)22-19(26)21-16-7-5-6-14(12-16)18(24)25-4/h5-12H,1-4H3,(H2,21,22,23,26)
InChIKey RUNGZCJDDNCNLZ-UHFFFAOYSA-N
Mol Weight 370.47 g/mol
Molecular Formula C20H22N2O3S
Exact Mass 370.135114 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H93Zfd3khPj
Name m-[3-(p-tert-BUTYLBENZOYL)-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 C20H22N2O3S
InChI InChI=1S/C20H22N2O3S/c1-20(2,3)15-10-8-13(9-11-15)17(23)22-19(26)21-16-7-5-6-14(12-16)18(24)25-4/h5-12H,1-4H3,(H2,21,22,23,26)
InChIKey RUNGZCJDDNCNLZ-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 123-125C
Molecular Weight 370.47
Solvent CDCl3; Reference=TMS; Temperature 297K