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3H-pyrazol-3-one, 2-(2-benzothiazolyl)-4-[(1E)-1-[[(E)-(4-fluorophenyl)methyl]imino]ethyl]-1,2-dihydro-5-phenyl-
SpectraBase Compound ID LvOvcmWoz24
InChI InChI=1S/C25H19FN4OS/c1-16(27-15-17-11-13-19(26)14-12-17)22-23(18-7-3-2-4-8-18)29-30(24(22)31)25-28-20-9-5-6-10-21(20)32-25/h2-14,29H,15H2,1H3/b27-16+
InChIKey HGMLPDPARCTNCY-JVWAILMASA-N
Mol Weight 442.51 g/mol
Molecular Formula C25H19FN4OS
Exact Mass 442.126361 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BCCMAHPArjq
Name 3H-pyrazol-3-one, 2-(2-benzothiazolyl)-4-[(1E)-1-[[(E)-(4-fluorophenyl)methyl]imino]ethyl]-1,2-dihydro-5-phenyl-
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/C25H19FN4OS/c1-16(27-15-17-11-13-19(26)14-12-17)22-23(18-7-3-2-4-8-18)29-30(24(22)31)25-28-20-9-5-6-10-21(20)32-25/h2-14,29H,15H2,1H3/b27-16+
InChIKey HGMLPDPARCTNCY-JVWAILMASA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_165
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/11249861