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2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl but-2-yl ester
SpectraBase Compound ID 5HkFE4jxeco
InChI InChI=1S/C18H18ClNO4/c1-3-12(2)24-18(22)16-9-5-8-15(20-16)17(21)23-11-13-6-4-7-14(19)10-13/h4-10,12H,3,11H2,1-2H3
InChIKey NVMVOKSSRREMAX-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 37EgqZaW78B
Name 2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl but-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18ClNO4
InChI InChI=1S/C18H18ClNO4/c1-3-12(2)24-18(22)16-9-5-8-15(20-16)17(21)23-11-13-6-4-7-14(19)10-13/h4-10,12H,3,11H2,1-2H3
InChIKey NVMVOKSSRREMAX-UHFFFAOYSA-N
Molecular Weight 347.798 g/mol
SMILES c1(nc(ccc1)C(OC(CC)C)=O)C(OCc1cccc(c1)Cl)=O
SPLASH splash10-00b9-2910000000-ed528b449cb8a24edaa3
Source of Spectrum TIPS-2023-1018-0
Wiley ID 1885724