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(5Z)-2-azanylidene-3-(4-chlorophenyl)-5-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene]-1,3-thiazolidin-4-one
SpectraBase Compound ID 66bWnQRW4I4
InChI InChI=1S/C19H12ClFN4OS/c20-13-3-7-15(8-4-13)25-18(26)16(27-19(25)22)9-12-10-23-24-17(12)11-1-5-14(21)6-2-11/h1-10,22H,(H,23,24)/b16-9-,22-19?
InChIKey XXCAZJSCFPKEHQ-KCBCAQTCSA-N
Mol Weight 398.84 g/mol
Molecular Formula C19H12ClFN4OS
Exact Mass 398.040438 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GYRuJlO06Qp
Name 4-thiazolidinone, 3-(4-chlorophenyl)-5-[[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylene]-2-imino-, (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 398.040438058 u
Formula C19H12ClFN4OS
InChI InChI=1S/C19H12ClFN4OS/c20-13-3-7-15(8-4-13)25-18(26)16(27-19(25)22)9-12-10-23-24-17(12)11-1-5-14(21)6-2-11/h1-10,22H,(H,23,24)/b16-9-,22-19?
InChIKey XXCAZJSCFPKEHQ-KCBCAQTCSA-N
Molecular Weight 398.843 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14638
Solvent DMSO-d6
Source Vendor ID: NMR/10320404; Lab Info: SAD; Lab Number: SAD-dast014