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2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl pent-2-yl ester
SpectraBase Compound ID Dz0aIlMFCz5
InChI InChI=1S/C19H20ClNO4/c1-3-6-13(2)25-19(23)17-10-5-9-16(21-17)18(22)24-12-14-7-4-8-15(20)11-14/h4-5,7-11,13H,3,6,12H2,1-2H3
InChIKey LHJQBRLXEZOHRE-UHFFFAOYSA-N
Mol Weight 361.83 g/mol
Molecular Formula C19H20ClNO4
Exact Mass 361.108086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aRALQYg2Fx
Name 2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl pent-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20ClNO4
InChI InChI=1S/C19H20ClNO4/c1-3-6-13(2)25-19(23)17-10-5-9-16(21-17)18(22)24-12-14-7-4-8-15(20)11-14/h4-5,7-11,13H,3,6,12H2,1-2H3
InChIKey LHJQBRLXEZOHRE-UHFFFAOYSA-N
Molecular Weight 361.825 g/mol
SMILES c1(nc(ccc1)C(OC(CCC)C)=O)C(OCc1cccc(c1)Cl)=O
SPLASH splash10-00dl-2910000000-f8c885a3bc2b6399886b
Source of Spectrum TIPS-2023-1019-0
Wiley ID 1885725