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Nicotinic acid, 1,6-dihydro-4-hydroxy-6-oxo-2-propyl-, ethyl ester
SpectraBase Compound ID 58Hj3JPxVAT
InChI InChI=1S/C11H15NO4/c1-3-5-7-10(11(15)16-4-2)8(13)6-9(14)12-7/h6H,3-5H2,1-2H3,(H2,12,13,14)
InChIKey GJCOGOMPYMFFHP-UHFFFAOYSA-N
Mol Weight 225.24 g/mol
Molecular Formula C11H15NO4
Exact Mass 225.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVbGQ2MsLSy
Name Nicotinic acid, 1,6-dihydro-4-hydroxy-6-oxo-2-propyl-, ethyl ester
CAS Registry Number 1211-05-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO4
InChI InChI=1S/C11H15NO4/c1-3-5-7-10(11(15)16-4-2)8(13)6-9(14)12-7/h6H,3-5H2,1-2H3,(H2,12,13,14)
InChIKey GJCOGOMPYMFFHP-UHFFFAOYSA-N
Molecular Weight 225.244 g/mol
SMILES N1C(=C(C(C=C1O)=O)C(=O)OCC)CCC
SPLASH splash10-0006-9600000000-ed8a97c13daa9684b6fa
Source of Spectrum T-66-942-0
Synonyms Ethyl 4,6-dihydroxy-2-propylnicotinate Ethyl 6-hydroxy-4-oxo-2-propyl-1H-pyridine-3-carboxylate 4-Hydroxy-6-oxo-2-propyl-1H-pyridine-3-carboxylic acid ethyl ester Ethyl 4-hydroxy-6-oxo-2-propyl-1H-pyridine-3-carboxylate Ethyl 4-oxidanyl-6-oxidanylidene-2-propyl-1H-pyridine-3-carboxylate
Wiley ID 1226285