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TWJZVXRMXVNSIE-UHFFFAOYSA-N
SpectraBase Compound ID 908L9gya75A
InChI InChI=1S/C8H5N3O4/c12-7-5-3-4(11(14)15)1-2-6(5)9-8(13)10-7/h1-3H,(H2,9,10,12,13)
InChIKey TWJZVXRMXVNSIE-UHFFFAOYSA-N
Mol Weight 207.14 g/mol
Molecular Formula C8H5N3O4
Exact Mass 207.028006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FfwGQ2mhoOi
Name 6-NITROQUINAZOLINE-2,4-(1H,3H)-DIONE
Compound Number 2225
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H5N3O4
InChI InChI=1S/C8H5N3O4/c12-7-5-3-4(11(14)15)1-2-6(5)9-8(13)10-7/h1-3H,(H2,9,10,12,13)
InChIKey TWJZVXRMXVNSIE-UHFFFAOYSA-N
Literature Reference Author W.ROBIEN
Literature Reference Citation W.ROBIEN,PRIVATE_COMMUNICATION
Molecular Weight 207.145 g/mol
Sample ID 2580
Solvent DMSO-D6