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2,4-DINITROPHENYL-4,6-DINITROTRIAZOLE-1-OXIDE;DNP-DNBT
SpectraBase Compound ID Bx5Cu3hK4vr
InChI InChI=1S/C12H5N7O9/c20-15-10-4-7(17(23)24)5-11(19(27)28)12(10)13-14(15)8-2-1-6(16(21)22)3-9(8)18(25)26/h1-5H
InChIKey IPNODCZJRFFQMP-UHFFFAOYSA-N
Mol Weight 391.21 g/mol
Molecular Formula C12H5N7O9
Exact Mass 391.014875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IRWNE2A4eay
Name 2,4-DINITROPHENYL-4,6-DINITROTRIAZOLE-1-OXIDE;DNP-DNBT
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H5N7O9
InChI InChI=1S/C12H5N7O9/c20-15-10-4-7(17(23)24)5-11(19(27)28)12(10)13-14(15)8-2-1-6(16(21)22)3-9(8)18(25)26/h1-5H
InChIKey IPNODCZJRFFQMP-UHFFFAOYSA-N
Literature Reference Author J.M.DUST,R.A.MANDERVILLE
Literature Reference Citation CAN.J.CHEM.,76,662(1998)
Literature Reference DOI 10.1139/cjc-76-6-662
Molecular Weight 391.213 g/mol
Solvent DMSO-D6
Source File Reference UWMZ11697