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SETMHPMHMKVVCD-UHFFFAOYSA-N

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SETMHPMHMKVVCD-UHFFFAOYSA-N
SpectraBase Compound ID IyqeSzTKiXN
InChI InChI=1S/C9H8N2O3/c12-8(7-2-1-3-10-6-7)11-4-5-14-9(11)13/h1-3,6H,4-5H2
InChIKey SETMHPMHMKVVCD-UHFFFAOYSA-N
Mol Weight 192.17 g/mol
Molecular Formula C9H8N2O3
Exact Mass 192.053492 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 67PfKPO7Oqq
Name SETMHPMHMKVVCD-UHFFFAOYSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8N2O3
InChI InChI=1S/C9H8N2O3/c12-8(7-2-1-3-10-6-7)11-4-5-14-9(11)13/h1-3,6H,4-5H2
InChIKey SETMHPMHMKVVCD-UHFFFAOYSA-N
Literature Reference Author S.YAMADA,T.MISONO,S.TSUZUKI
Literature Reference Citation J.AM.CHEM.SOC.,126,9862(2004)
Literature Reference DOI 10.1021/ja0490119
Molecular Weight 192.174 g/mol
Solvent CDCl3
Source File Reference UWLU34947