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3,5-dinitro-N-(4H-1,2,4-triazol-4-yl)benzamide

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3,5-dinitro-N-(4H-1,2,4-triazol-4-yl)benzamide
SpectraBase Compound ID 2luQX8VJ4GM
InChI InChI=1S/C9H6N6O5/c16-9(12-13-4-10-11-5-13)6-1-7(14(17)18)3-8(2-6)15(19)20/h1-5H,(H,12,16)
InChIKey SBEBHSYNBJSEGB-UHFFFAOYSA-N
Mol Weight 278.18 g/mol
Molecular Formula C9H6N6O5
Exact Mass 278.039967 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8iMgmthDWE1
Name 3,5-dinitro-N-(4H-1,2,4-triazol-4-yl)benzamide
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/C9H6N6O5/c16-9(12-13-4-10-11-5-13)6-1-7(14(17)18)3-8(2-6)15(19)20/h1-5H,(H,12,16)
InChIKey SBEBHSYNBJSEGB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3927
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/8105532; UBI_ID: UBI-003928
Temperature 313 °C