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4,8-DIHYDROXIMINO-4-H,8-H-BENZO-[1.2-C:4.5-C']-BIS-[1.2.5]-OXADIAZOLE
SpectraBase Compound ID 1T3ibyvNdY5
InChI InChI=1S/2C6H2N6O4/c2*13-7-1-3-5(11-15-9-3)2(8-14)6-4(1)10-16-12-6/h2*13-14H/b2*7-1-,8-2+
InChIKey YVNAXDIGPQUKNC-BLDKCPQASA-N
Mol Weight 444.24 g/mol
Molecular Formula C12H4N12O8
Exact Mass 444.027505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5XHpTWdxHKD
Name 4,8-DIHYDROXIMINO-4-H,8-H-BENZO-[1.2-C:4.5-C']-BIS-[1.2.5]-OXADIAZOLE
Compound Number VII-A_AND_VII-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12N12O8
InChI InChI=1S/2C6H2N6O4/c2*13-7-1-3-5(11-15-9-3)2(8-14)6-4(1)10-16-12-6/h2*13-14H/b2*7-1-,8-2+
InChIKey YVNAXDIGPQUKNC-BLDKCPQASA-N
Literature Reference Author V.A.SAMSONOV,L.V.VOLODARSKII,G.K.KHISAMUTDINOV
Literature Reference Citation CHEM.HET.COMP.,33,471(1997)
Literature Reference DOI 10.1007/bf02321395
Molecular Weight 440.208 g/mol
Solvent DMSO-D6
Source File Reference UWMZ14429