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3,4-Pyridinedicarboxylic acid, 5-cyano-1,6-dihydro-6-oxo-1-phenyl-, dimethyl ester
SpectraBase Compound ID FVQOZGBttm3
InChI InChI=1S/C16H12N2O5/c1-22-15(20)12-9-18(10-6-4-3-5-7-10)14(19)11(8-17)13(12)16(21)23-2/h3-7,9H,1-2H3
InChIKey QBIYRBNRYJBWCE-UHFFFAOYSA-N
Mol Weight 312.28 g/mol
Molecular Formula C16H12N2O5
Exact Mass 312.074621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DE6dIVIsTtB
Name 3,4-Pyridinedicarboxylic acid, 5-cyano-1,6-dihydro-6-oxo-1-phenyl-, dimethyl ester
Alternate Name(s) Dimethyl 3-cyano-1-phenyl-2(1H)-pyridine-4,5-dicarboxylate Dimethyl 5-Cyano-1-phenylpyridine-6-one-3,4-dicarboxylate Dimethyl 5-cyano-6-oxo-1-phenyl-1,6-dihydro-3,4-pyridinedicarboxylate 5-cyano-6-oxo-1-phenylpyridine-3,4-dicarboxylic acid dimethyl ester Dimethyl 5-cyano-6-oxo-1-phenylpyridine-3,4-dicarboxylate Dimethyl 5-cyano-6-oxo-1-phenyl-pyridine-3,4-dicarboxylate Dimethyl 5-cyano-6-oxidanylidene-1-phenyl-pyridine-3,4-dicarboxylate
CAS Registry Number 106718-90-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N2O5
InChI InChI=1S/C16H12N2O5/c1-22-15(20)12-9-18(10-6-4-3-5-7-10)14(19)11(8-17)13(12)16(21)23-2/h3-7,9H,1-2H3
InChIKey QBIYRBNRYJBWCE-UHFFFAOYSA-N
Molecular Weight 312.281 g/mol
SMILES C1=C(C(=C(C(N1c1ccccc1)=O)C#N)C(=O)OC)C(=O)OC
SPLASH splash10-0ik9-0096000000-d38fc8508e867f64b074
Source of Spectrum F-67-7907-7
Wiley ID 1571093