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2-Methyl-6-[(E)-2-phenylethenyl]pyridine-3,4-dicarboxylic acid
SpectraBase Compound ID E7djZ5WeK26
InChI InChI=1S/C16H13NO4/c1-10-14(16(20)21)13(15(18)19)9-12(17-10)8-7-11-5-3-2-4-6-11/h2-9H,1H3,(H,18,19)(H,20,21)/b8-7+
InChIKey CXWNDCWDCBCYEB-BQYQJAHWSA-N
Mol Weight 283.28 g/mol
Molecular Formula C16H13NO4
Exact Mass 283.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JXazXwiOQFU
Name 2-Methyl-6-[(E)-2-phenylethenyl]pyridine-3,4-dicarboxylic acid
Alternate Name(s) 2-Methyl-6-[(E)-styryl]cinchomeronic acid 2-Methyl-6-[(E)-styryl]pyridine-3,4-dicarboxylic acid
CAS Registry Number 58510-19-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO4
InChI InChI=1S/C16H13NO4/c1-10-14(16(20)21)13(15(18)19)9-12(17-10)8-7-11-5-3-2-4-6-11/h2-9H,1H3,(H,18,19)(H,20,21)/b8-7+
InChIKey CXWNDCWDCBCYEB-BQYQJAHWSA-N
Molecular Weight 283.283 g/mol
SMILES OC(c1c(C(=O)O)c(nc(c1)\C=C\c1ccccc1)C)=O
SPLASH splash10-0296-0590000000-1222baf9612685e572cd
Source of Spectrum Y-12-1300-0
Wiley ID 1286950