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Benzofurazan, 4-nitro-, 1-oxide

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Benzofurazan, 4-nitro-, 1-oxide
SpectraBase Compound ID 5N2KcqQGrED
InChI InChI=1S/C6H3N3O4/c10-8(11)4-2-1-3-5-6(4)7-13-9(5)12/h1-3H
InChIKey XUCKCDGEIRMZPM-UHFFFAOYSA-N
Mol Weight 181.11 g/mol
Molecular Formula C6H3N3O4
Exact Mass 181.012356 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8YRYiPKX9OE
Name 4-Nitro-benzofuroxan
CAS Registry Number 18771-85-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H3N3O4
InChI InChI=1S/C6H3N3O4/c10-8(11)4-2-1-3-5-6(4)7-13-9(5)12/h1-3H
InChIKey XUCKCDGEIRMZPM-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference M. Witanowski, L. Stefaniak, G. Webb, Org. Magn. Resonance 14, 356 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6