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pyrimidine, 2-[[5-(4-isothiocyanatophenyl)-1,3,4-oxadiazol-2-yl]thio]-
SpectraBase Compound ID DGHDKfiwPmX
InChI InChI=1S/C13H7N5OS2/c20-8-16-10-4-2-9(3-5-10)11-17-18-13(19-11)21-12-14-6-1-7-15-12/h1-7H
InChIKey QHTSHLGYCJSCDA-UHFFFAOYSA-N
Mol Weight 313.35 g/mol
Molecular Formula C13H7N5OS2
Exact Mass 313.009202 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ae0m0kqG1co
Name pyrimidine, 2-[[5-(4-isothiocyanatophenyl)-1,3,4-oxadiazol-2-yl]thio]-
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/C13H7N5OS2/c20-8-16-10-4-2-9(3-5-10)11-17-18-13(19-11)21-12-14-6-1-7-15-12/h1-7H
InChIKey QHTSHLGYCJSCDA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_6552
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/10241705; Labnumber: RGG-0400027
Temperature 303 °C