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2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl isopropyl ester
SpectraBase Compound ID CN3zVV9v6Hn
InChI InChI=1S/C17H16ClNO4/c1-11(2)23-17(21)15-8-4-7-14(19-15)16(20)22-10-12-5-3-6-13(18)9-12/h3-9,11H,10H2,1-2H3
InChIKey DBMATIAWRJESOF-UHFFFAOYSA-N
Mol Weight 333.77 g/mol
Molecular Formula C17H16ClNO4
Exact Mass 333.076786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ao5M1PAZpFB
Name 2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl isopropyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16ClNO4
InChI InChI=1S/C17H16ClNO4/c1-11(2)23-17(21)15-8-4-7-14(19-15)16(20)22-10-12-5-3-6-13(18)9-12/h3-9,11H,10H2,1-2H3
InChIKey DBMATIAWRJESOF-UHFFFAOYSA-N
Molecular Weight 333.771 g/mol
SMILES c1(nc(ccc1)C(OC(C)C)=O)C(OCc1cccc(c1)Cl)=O
SPLASH splash10-01b9-2900000000-3cf2356079ea77935308
Source of Spectrum TIPS-2023-1017-0
Wiley ID 1885723