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2,1,3-benzothiadiazole, 7-chloro-5-[(4,6-dimethyl-2-pyrimidinyl)thio]-4-nitro-
SpectraBase Compound ID H0rrdhTtR0k
InChI InChI=1S/C12H8ClN5O2S2/c1-5-3-6(2)15-12(14-5)21-8-4-7(13)9-10(17-22-16-9)11(8)18(19)20/h3-4H,1-2H3
InChIKey LKUBELGKSWTFKU-UHFFFAOYSA-N
Mol Weight 353.8 g/mol
Molecular Formula C12H8ClN5O2S2
Exact Mass 352.980795 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GWhHtIoJzty
Name 2,1,3-benzothiadiazole, 7-chloro-5-[(4,6-dimethyl-2-pyrimidinyl)thio]-4-nitro-
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/C12H8ClN5O2S2/c1-5-3-6(2)15-12(14-5)21-8-4-7(13)9-10(17-22-16-9)11(8)18(19)20/h3-4H,1-2H3
InChIKey LKUBELGKSWTFKU-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_4599
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/11318711