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3,4-Pyridinedicarboxylic acid, 2,5,6-triphenyl-, dimethyl ester
SpectraBase Compound ID 17zOjFhp2a0
InChI InChI=1S/C27H21NO4/c1-31-26(29)22-21(18-12-6-3-7-13-18)24(19-14-8-4-9-15-19)28-25(23(22)27(30)32-2)20-16-10-5-11-17-20/h3-17H,1-2H3
InChIKey HRDSSKGBNZTWIL-UHFFFAOYSA-N
Mol Weight 423.47 g/mol
Molecular Formula C27H21NO4
Exact Mass 423.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dovmhnf9MAj
Name 3,4-Pyridinedicarboxylic acid, 2,5,6-triphenyl-, dimethyl ester
CAS Registry Number 58329-12-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H21NO4
InChI InChI=1S/C27H21NO4/c1-31-26(29)22-21(18-12-6-3-7-13-18)24(19-14-8-4-9-15-19)28-25(23(22)27(30)32-2)20-16-10-5-11-17-20/h3-17H,1-2H3
InChIKey HRDSSKGBNZTWIL-UHFFFAOYSA-N
Molecular Weight 423.468 g/mol
SMILES c1(c(c(-c2ccccc2)c(nc1-c1ccccc1)-c1ccccc1)C(=O)OC)C(=O)OC
SPLASH splash10-00di-0001900000-4794c49d7774b8def9d6
Source of Spectrum AJ-58-155-2
Synonyms Dimethyl 2,5,6-triphenylpyridine-3,4-dicarboxylate
Wiley ID 1378999