For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

m-(3-benzyl-2-thioureido)benzoic acid, methyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

m-(3-benzyl-2-thioureido)benzoic acid, methyl ester
SpectraBase Compound ID DsqzWdP03eD
InChI InChI=1S/C16H16N2O2S/c1-20-15(19)13-8-5-9-14(10-13)18-16(21)17-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H2,17,18,21)
InChIKey QRIILLRUAFDCRB-UHFFFAOYSA-N
Mol Weight 300.38 g/mol
Molecular Formula C16H16N2O2S
Exact Mass 300.093249 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 13ZM2lA6HvY
Name m-(3-BENZYL-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 C16H16N2O2S
InChI InChI=1S/C16H16N2O2S/c1-20-15(19)13-8-5-9-14(10-13)18-16(21)17-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H2,17,18,21)
InChIKey QRIILLRUAFDCRB-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 169-170C
Molecular Weight 300.38
Solvent DMSO-d6; Reference=TMS; Temperature 297K