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(5)6-NITRO-BENZOTRIAZOLE

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(5)6-NITRO-BENZOTRIAZOLE
SpectraBase Compound ID 3M3svQCrvo8
InChI InChI=1S/2C6H4N4O2/c2*11-10(12)4-1-2-5-6(3-4)8-9-7-5/h2*1-3H,(H,7,8,9)
InChIKey SSFBIKSZJGBERK-UHFFFAOYSA-N
Mol Weight 328.25 g/mol
Molecular Formula C12H8N8O4
Exact Mass 328.066851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9wbpbDZTg6c
Name (5)6-NITRO-BENZOTRIAZOLE
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H8N8O4
InChI InChI=1S/2C6H4N4O2/c2*11-10(12)4-1-2-5-6(3-4)8-9-7-5/h2*1-3H,(H,7,8,9)
InChIKey SSFBIKSZJGBERK-UHFFFAOYSA-N
Literature Reference Author L.I.LARINA,V.MILATA
Literature Reference Citation MAGN.RES.CHEM.,47,142(2009)
Literature Reference DOI 10.1002/mrc.2366
Molecular Weight 328.247 g/mol
Solvent DMSO-D6
Source File Reference UWLU79400