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2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl butyl ester
SpectraBase Compound ID 4Azy6H43ipZ
InChI InChI=1S/C18H18ClNO4/c1-2-3-10-23-17(21)15-8-5-9-16(20-15)18(22)24-12-13-6-4-7-14(19)11-13/h4-9,11H,2-3,10,12H2,1H3
InChIKey HBMRMZQTLITKAW-UHFFFAOYSA-N
Mol Weight 347.8 g/mol
Molecular Formula C18H18ClNO4
Exact Mass 347.092436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GIuSEpoLz2
Name 2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18ClNO4
InChI InChI=1S/C18H18ClNO4/c1-2-3-10-23-17(21)15-8-5-9-16(20-15)18(22)24-12-13-6-4-7-14(19)11-13/h4-9,11H,2-3,10,12H2,1H3
InChIKey HBMRMZQTLITKAW-UHFFFAOYSA-N
Molecular Weight 347.798 g/mol
SMILES c1(nc(ccc1)C(OCCCC)=O)C(OCc1cccc(c1)Cl)=O
SPLASH splash10-004i-2900000000-b5ca60d89c2e774a720c
Source of Spectrum TIPS-2023-1011-0
Wiley ID 1885717