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benzoic acid, 4-[[(2E)-5-[(4-methoxyphenyl)methyl]-4-oxo-3-(2-propenyl)thiazolidinylidene]amino]-
SpectraBase Compound ID 777zaM3kT6p
InChI InChI=1S/C21H20N2O4S/c1-3-12-23-19(24)18(13-14-4-10-17(27-2)11-5-14)28-21(23)22-16-8-6-15(7-9-16)20(25)26/h3-11,18H,1,12-13H2,2H3,(H,25,26)/b22-21+
InChIKey IVHPZYYOEFYKPQ-QURGRASLSA-N
Mol Weight 396.46 g/mol
Molecular Formula C21H20N2O4S
Exact Mass 396.114378 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3NR3nLpbW21
Name benzoic acid, 4-[[(2E)-5-[(4-methoxyphenyl)methyl]-4-oxo-3-(2-propenyl)thiazolidinylidene]amino]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H20N2O4S/c1-3-12-23-19(24)18(13-14-4-10-17(27-2)11-5-14)28-21(23)22-16-8-6-15(7-9-16)20(25)26/h3-11,18H,1,12-13H2,2H3,(H,25,26)/b22-21+
InChIKey IVHPZYYOEFYKPQ-QURGRASLSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_1145
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/8295521; Labnumber: OBU-md00132
Temperature 297 °C