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PQDVCHGSZCBZKG-UHFFFAOYSA-N
SpectraBase Compound ID IYtWGChF0fx
InChI InChI=1S/C16H12N4O/c17-15-13-14(21)11-8-4-5-9-12(11)20(16(13)19-18-15)10-6-2-1-3-7-10/h1-9H,(H3,17,18,19)
InChIKey PQDVCHGSZCBZKG-UHFFFAOYSA-N
Mol Weight 276.3 g/mol
Molecular Formula C16H12N4O
Exact Mass 276.101111 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 75BVt0YBr9G
Name PQDVCHGSZCBZKG-UHFFFAOYSA-N
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12N4O
InChI InChI=1S/C16H12N4O/c17-15-13-14(21)11-8-4-5-9-12(11)20(16(13)19-18-15)10-6-2-1-3-7-10/h1-9H,(H3,17,18,19)
InChIKey PQDVCHGSZCBZKG-UHFFFAOYSA-N
Literature Reference Author J.N.DOMINGUEZ,J.E.CHARRIS,W.BASANTE,B.MENDEZ
Literature Reference Citation MAGN.RES.CHEM.,36,454(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199806)36:6<454::aid-omr249>3.3.co;2-m
Molecular Weight 276.297 g/mol
Solvent DMSO-D6
Source File Reference UWRU1122