For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-Chloro-2-keto-4,6-dimethyl-1H-pyridine-3-carboxylic acid butyl ester
SpectraBase Compound ID 5UgXk6420LR
InChI InChI=1S/C12H16ClNO3/c1-4-5-6-17-12(16)9-7(2)10(13)8(3)14-11(9)15/h4-6H2,1-3H3,(H,14,15)
InChIKey VZEICTVLYYTHTC-UHFFFAOYSA-N
Mol Weight 257.72 g/mol
Molecular Formula C12H16ClNO3
Exact Mass 257.081871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID C5VVBRiTpKN
Name 5-Chloro-2-keto-4,6-dimethyl-1H-pyridine-3-carboxylic acid butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16ClNO3
InChI InChI=1S/C12H16ClNO3/c1-4-5-6-17-12(16)9-7(2)10(13)8(3)14-11(9)15/h4-6H2,1-3H3,(H,14,15)
InChIKey VZEICTVLYYTHTC-UHFFFAOYSA-N
Molecular Weight 257.717 g/mol
SMILES Oc1c(c(c(c(C)n1)Cl)C)C(=O)OCCCC
SPLASH splash10-053r-6910000000-495e791e123a8595578c
Synonyms 5-Chloro-4,6-dimethyl-2-oxo-1,2-dihydro-pyridine-3-carboxylic acid butyl ester 5-Chloro-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxylic acid butyl ester Butyl 5-chloranyl-4,6-dimethyl-2-oxidanylidene-1H-pyridine-3-carboxylate Butyl 5-chloro-4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinecarboxylate Butyl 5-chloro-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxylate
Wiley ID 1464474