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2'-Imino-5'-(3-phenyl-1H-pyrazol-4-ylmethylene)-[2,3']bithiazolyl-4'-one
SpectraBase Compound ID HXa5DvxzLoF
InChI InChI=1S/C16H11N5OS2/c17-15-21(16-18-6-7-23-16)14(22)12(24-15)8-11-9-19-20-13(11)10-4-2-1-3-5-10/h1-9,17H,(H,19,20)/b12-8-,17-15?
InChIKey LGRPROGIGHZADR-QDKNBVMZSA-N
Mol Weight 353.42 g/mol
Molecular Formula C16H11N5OS2
Exact Mass 353.040502 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KShspYJs6TB
Name 4-thiazolidinone, 2-imino-5-[(3-phenyl-1H-pyrazol-4-yl)methylene]-3-(2-thiazolyl)-, (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 353.040502341 u
Formula C16H11N5OS2
InChI InChI=1S/C16H11N5OS2/c17-15-21(16-18-6-7-23-16)14(22)12(24-15)8-11-9-19-20-13(11)10-4-2-1-3-5-10/h1-9,17H,(H,19,20)/b12-8-,17-15?
InChIKey LGRPROGIGHZADR-QDKNBVMZSA-N
Molecular Weight 353.418 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17544
Solvent DMSO-d6
Source Vendor ID: NMR/11210029; Lab Info: SAD; Lab Number: 37