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2-thiophenecarboxylic acid, 3-[[[(2-phenylethyl)(phenylmethyl)amino]carbonothioyl]amino]-, methyl ester
SpectraBase Compound ID Il1nWLHLYaL
InChI InChI=1S/C22H22N2O2S2/c1-26-21(25)20-19(13-15-28-20)23-22(27)24(16-18-10-6-3-7-11-18)14-12-17-8-4-2-5-9-17/h2-11,13,15H,12,14,16H2,1H3,(H,23,27)
InChIKey LGMDHHIBXNIMKS-UHFFFAOYSA-N
Mol Weight 410.55 g/mol
Molecular Formula C22H22N2O2S2
Exact Mass 410.11227 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F1LbQv2s1WA
Name 2-thiophenecarboxylic acid, 3-[[[(2-phenylethyl)(phenylmethyl)amino]carbonothioyl]amino]-, methyl 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 410.112270302 u
Formula C22H22N2O2S2
InChI InChI=1S/C22H22N2O2S2/c1-26-21(25)20-19(13-15-28-20)23-22(27)24(16-18-10-6-3-7-11-18)14-12-17-8-4-2-5-9-17/h2-11,13,15H,12,14,16H2,1H3,(H,23,27)
InChIKey LGMDHHIBXNIMKS-UHFFFAOYSA-N
Molecular Weight 410.550 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1039
Solvent DMSO-d6
Source Vendor ID: NMR/13239624