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1-methyl-4-nitro-N-(6-nitro-1,3-benzothiazol-2-yl)-1H-pyrazole-3-carboxamide
SpectraBase Compound ID GQ5Thu06wT2
InChI InChI=1S/C12H8N6O5S/c1-16-5-8(18(22)23)10(15-16)11(19)14-12-13-7-3-2-6(17(20)21)4-9(7)24-12/h2-5H,1H3,(H,13,14,19)
InChIKey NXKVXJQUPRNLCH-UHFFFAOYSA-N
Mol Weight 348.29 g/mol
Molecular Formula C12H8N6O5S
Exact Mass 348.027689 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IQ5Un3o0Ck4
Name 1-methyl-4-nitro-N-(6-nitro-1,3-benzothiazol-2-yl)-1H-pyrazole-3-carboxamide
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/C12H8N6O5S/c1-16-5-8(18(22)23)10(15-16)11(19)14-12-13-7-3-2-6(17(20)21)4-9(7)24-12/h2-5H,1H3,(H,13,14,19)
InChIKey NXKVXJQUPRNLCH-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15365
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: UZI/6219702; UBI_ID: UBI-015368
Temperature 313 °C