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2,5,6,7-TETRAHYDRO-2-OXO-1H-1-PYRINDINE-3-CARBONITRILE
SpectraBase Compound ID DRF7fab5ZWA
InChI InChI=1S/C9H8N2O/c10-5-7-4-6-2-1-3-8(6)11-9(7)12/h4H,1-3H2,(H,11,12)
InChIKey CNZRRQHIZFDOSX-UHFFFAOYSA-N
Mol Weight 160.18 g/mol
Molecular Formula C9H8N2O
Exact Mass 160.063663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1GEGvA43r22
Name 2,5,6,7-TETRAHYDRO-2-OXO-1H-1-PYRINDINE-3-CARBONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8N2O
InChI InChI=1S/C9H8N2O/c10-5-7-4-6-2-1-3-8(6)11-9(7)12/h4H,1-3H2,(H,11,12)
InChIKey CNZRRQHIZFDOSX-UHFFFAOYSA-N
Literature Reference Author J.B.PAINE-III
Literature Reference Citation J.HETCYCL.CHEM.,24,351(1987)
Literature Reference DOI 10.1002/jhet.5570240211
Molecular Weight 160.175 g/mol
Solvent CDCl3:CF3COOH=8:2
Source File Reference UWED7499