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3,4-Pyridinedicarboxylic acid, 5-chloro-1,6-dihydro-6-oxo-1-phenyl-, dimethyl ester
SpectraBase Compound ID 9zVSGeyAhLN
InChI InChI=1S/C15H12ClNO5/c1-21-14(19)10-8-17(9-6-4-3-5-7-9)13(18)12(16)11(10)15(20)22-2/h3-8H,1-2H3
InChIKey BGSZVSKZVYREDH-UHFFFAOYSA-N
Mol Weight 321.72 g/mol
Molecular Formula C15H12ClNO5
Exact Mass 321.0404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6SyUcOiASn1
Name 3,4-Pyridinedicarboxylic acid, 5-chloro-1,6-dihydro-6-oxo-1-phenyl-, dimethyl ester
Alternate Name(s) Dimethyl 3-chloro-1-phenyl-2(1H)-pyridone-4,5-dicarboxylate Dimethyl 5-chloro-6-oxo-1-phenyl-1,6-dihydro-3,4-pyridinedicarboxylate
CAS Registry Number 106718-91-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClNO5
InChI InChI=1S/C15H12ClNO5/c1-21-14(19)10-8-17(9-6-4-3-5-7-9)13(18)12(16)11(10)15(20)22-2/h3-8H,1-2H3
InChIKey BGSZVSKZVYREDH-UHFFFAOYSA-N
Molecular Weight 321.716 g/mol
SMILES C=1(C(=C(Cl)C(N(C1)c1ccccc1)=O)C(=O)OC)C(=O)OC
SPLASH splash10-0fk9-0095000000-16f2f1f8276bd0adfccc
Source of Spectrum F-46-5729-8
Wiley ID 1320797