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1,4-benzenedicarboxylic acid, 2-[[[ethyl(phenylmethyl)amino]carbonothioyl]amino]-, dimethyl ester
SpectraBase Compound ID Acwz83ATGDg
InChI InChI=1S/C20H22N2O4S/c1-4-22(13-14-8-6-5-7-9-14)20(27)21-17-12-15(18(23)25-2)10-11-16(17)19(24)26-3/h5-12H,4,13H2,1-3H3,(H,21,27)
InChIKey CYTGEANCIIAFAK-UHFFFAOYSA-N
Mol Weight 386.47 g/mol
Molecular Formula C20H22N2O4S
Exact Mass 386.130028 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HxhZcmRZgsF
Name 1,4-benzenedicarboxylic acid, 2-[[[ethyl(phenylmethyl)amino]carbonothioyl]amino]-, dimethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.130028366 u
Formula C20H22N2O4S
InChI InChI=1S/C20H22N2O4S/c1-4-22(13-14-8-6-5-7-9-14)20(27)21-17-12-15(18(23)25-2)10-11-16(17)19(24)26-3/h5-12H,4,13H2,1-3H3,(H,21,27)
InChIKey CYTGEANCIIAFAK-UHFFFAOYSA-N
Molecular Weight 386.466 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1023
Solvent DMSO-d6
Source Vendor ID: NMR/13239608