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benzoic acid, 4-[(4Z)-4,5-dihydro-4-[(2-methylphenyl)methylene]-5-oxo-2-(2-propenylthio)-1H-imidazol-1-yl]-, ethyl ester
SpectraBase Compound ID 68hNON9t9Ov
InChI InChI=1S/C23H22N2O3S/c1-4-14-29-23-24-20(15-18-9-7-6-8-16(18)3)21(26)25(23)19-12-10-17(11-13-19)22(27)28-5-2/h4,6-13,15H,1,5,14H2,2-3H3/b20-15-
InChIKey PQRDDLIEOZIHTE-HKWRFOASSA-N
Mol Weight 406.5 g/mol
Molecular Formula C23H22N2O3S
Exact Mass 406.135114 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F6QfVP22Qom
Name benzoic acid, 4-[(4Z)-4,5-dihydro-4-[(2-methylphenyl)methylene]-5-oxo-2-(2-propenylthio)-1H-imidazol-1-yl]-, ethyl 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 406.135113747 u
Formula C23H22N2O3S
InChI InChI=1S/C23H22N2O3S/c1-4-14-29-23-24-20(15-18-9-7-6-8-16(18)3)21(26)25(23)19-12-10-17(11-13-19)22(27)28-5-2/h4,6-13,15H,1,5,14H2,2-3H3/b20-15-
InChIKey PQRDDLIEOZIHTE-HKWRFOASSA-N
Molecular Weight 406.500 g/mol
NMR Offset 17.9973
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8018
Solvent DMSO-d6
Source Vendor ID: NMR/13308969