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4H-imidazol-4-one, 3-(3-chloro-4-fluorophenyl)-3,5-dihydro-2-mercapto-5-(phenylmethylene)-, (5Z)-

View entire compound with spectra: 1 NMR

4H-imidazol-4-one, 3-(3-chloro-4-fluorophenyl)-3,5-dihydro-2-mercapto-5-(phenylmethylene)-, (5Z)-
SpectraBase Compound ID 7pwBU9g3C4E
InChI InChI=1S/C16H10ClFN2OS/c17-12-9-11(6-7-13(12)18)20-15(21)14(19-16(20)22)8-10-4-2-1-3-5-10/h1-9H,(H,19,22)/b14-8-
InChIKey FWCFZNKNTLTFST-ZSOIEALJSA-N
Mol Weight 332.78 g/mol
Molecular Formula C16H10ClFN2OS
Exact Mass 332.01864 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3NUKaVjE6Fv
Name 4H-imidazol-4-one, 3-(3-chloro-4-fluorophenyl)-3,5-dihydro-2-mercapto-5-(phenylmethylene)-, (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 332.018639986 u
Formula C16H10ClFN2OS
InChI InChI=1S/C16H10ClFN2OS/c17-12-9-11(6-7-13(12)18)20-15(21)14(19-16(20)22)8-10-4-2-1-3-5-10/h1-9H,(H,19,22)/b14-8-
InChIKey FWCFZNKNTLTFST-ZSOIEALJSA-N
Molecular Weight 332.780 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2326
Solvent DMSO-d6
Source Vendor ID: NMR/13268612