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1,4-benzenedicarboxylic acid, 2-[[[methyl[2-(2-pyridinyl)ethyl]amino]carbonothioyl]amino]-, dimethyl ester
SpectraBase Compound ID 3Rx3cUbRmGy
InChI InChI=1S/C19H21N3O4S/c1-22(11-9-14-6-4-5-10-20-14)19(27)21-16-12-13(17(23)25-2)7-8-15(16)18(24)26-3/h4-8,10,12H,9,11H2,1-3H3,(H,21,27)
InChIKey ZSPKZUZYYLRXHD-UHFFFAOYSA-N
Mol Weight 387.45 g/mol
Molecular Formula C19H21N3O4S
Exact Mass 387.125277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K3bHIYl32y7
Name 1,4-benzenedicarboxylic acid, 2-[[[methyl[2-(2-pyridinyl)ethyl]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 387.125277338 u
Formula C19H21N3O4S
InChI InChI=1S/C19H21N3O4S/c1-22(11-9-14-6-4-5-10-20-14)19(27)21-16-12-13(17(23)25-2)7-8-15(16)18(24)26-3/h4-8,10,12H,9,11H2,1-3H3,(H,21,27)
InChIKey ZSPKZUZYYLRXHD-UHFFFAOYSA-N
Molecular Weight 387.454 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_811
Solvent DMSO-d6
Source Vendor ID: NMR/13239246