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3H-pyrazol-3-one, 2,4-dihydro-5-methyl-2-(4-phenyl-2-thiazolyl)-4-(2-thienylmethylene)-, (4E)-
SpectraBase Compound ID KyETJLbpW6G
InChI InChI=1S/C18H13N3OS2/c1-12-15(10-14-8-5-9-23-14)17(22)21(20-12)18-19-16(11-24-18)13-6-3-2-4-7-13/h2-11H,1H3/b15-10+
InChIKey GQRQUJIEEYRHOX-XNTDXEJSSA-N
Mol Weight 351.44 g/mol
Molecular Formula C18H13N3OS2
Exact Mass 351.050004 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5eL9Fq4kpyo
Name 3H-pyrazol-3-one, 2,4-dihydro-5-methyl-2-(4-phenyl-2-thiazolyl)-4-(2-thienylmethylene)-, (4E)-
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/C18H13N3OS2/c1-12-15(10-14-8-5-9-23-14)17(22)21(20-12)18-19-16(11-24-18)13-6-3-2-4-7-13/h2-11H,1H3/b15-10+
InChIKey GQRQUJIEEYRHOX-XNTDXEJSSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6951
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/12228855