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4H-imidazol-4-one, 3-(3-chloro-4-fluorophenyl)-5-[(4-ethoxy-3-methoxyphenyl)methylene]-2-(ethylthio)-3,5-dihydro-, (5Z)-
SpectraBase Compound ID KZLjYhjqTiX
InChI InChI=1S/C21H20ClFN2O3S/c1-4-28-18-9-6-13(11-19(18)27-3)10-17-20(26)25(21(24-17)29-5-2)14-7-8-16(23)15(22)12-14/h6-12H,4-5H2,1-3H3/b17-10-
InChIKey JNFBJEBYTIBIQH-YVLHZVERSA-N
Mol Weight 434.91 g/mol
Molecular Formula C21H20ClFN2O3S
Exact Mass 434.08672 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3nRDkKM3pPW
Name 4H-imidazol-4-one, 3-(3-chloro-4-fluorophenyl)-5-[(4-ethoxy-3-methoxyphenyl)methylene]-2-(ethylthio)-3,5-dihydro-, (5Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.086719546 u
Formula C21H20ClFN2O3S
InChI InChI=1S/C21H20ClFN2O3S/c1-4-28-18-9-6-13(11-19(18)27-3)10-17-20(26)25(21(24-17)29-5-2)14-7-8-16(23)15(22)12-14/h6-12H,4-5H2,1-3H3/b17-10-
InChIKey JNFBJEBYTIBIQH-YVLHZVERSA-N
Molecular Weight 434.913 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4848
Solvent DMSO-d6
Source Vendor ID: NMR/13288651