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5-Nitro-3-cyano-2(1H)-pyridone
SpectraBase Compound ID LZDmzcR34tn
InChI InChI=1S/C6H3N3O3/c7-2-4-1-5(9(11)12)3-8-6(4)10/h1,3H,(H,8,10)
InChIKey HLQZJYLEGMYYBY-UHFFFAOYSA-N
Mol Weight 165.11 g/mol
Molecular Formula C6H3N3O3
Exact Mass 165.017441 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1Y3qBoCWRM
Name 5-Nitro-3-cyano-2(1H)-pyridone
CAS Registry Number 31309-38-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H3N3O3
InChI InChI=1S/C6H3N3O3/c7-2-4-1-5(9(11)12)3-8-6(4)10/h1,3H,(H,8,10)
InChIKey HLQZJYLEGMYYBY-UHFFFAOYSA-N
Molecular Weight 165.108 g/mol
SMILES Oc1ncc(cc1C#N)N(=O)=O
SPLASH splash10-03fr-9200000000-10176d696d9cfe943848
Source of Spectrum JX-2012-274
Synonyms 2-Hydroxy-5-nitronicotinonitrile 5-Nitro-2-oxo-1,2-dihydro-3-pyridinecarbonitrile 5-Nitro-2-oxo-1,2-dihydropyridine-3-carbonitrile 5-Nitro-2-oxo-1H-pyridine-3-carbonitrile 5-Nitro-2-oxidanylidene-1H-pyridine-3-carbonitrile 3-Cyano-2-hydroxy-5-nitropyridine 2-keto-5-nitro-1H-pyridine-3-carbonitrile
Wiley ID 1660721