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3-Pyridinecarboxylic acid, 4-propyl-, ethyl ester
SpectraBase Compound ID J45EUiIvTPO
InChI InChI=1S/C11H15NO2/c1-3-5-9-6-7-12-8-10(9)11(13)14-4-2/h6-8H,3-5H2,1-2H3
InChIKey MXPISRLJXUZZOQ-UHFFFAOYSA-N
Mol Weight 193.25 g/mol
Molecular Formula C11H15NO2
Exact Mass 193.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlR81BpsVAa
Name 3-Pyridinecarboxylic acid, 4-propyl-, ethyl ester
Alternate Name(s) (4-propyl-3-pyridinalmethyl)ethanoate Ethyl 4-propyl-3-pyridinecarboxylate Ethyl 4-propylnicotinate
CAS Registry Number 111341-53-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO2
InChI InChI=1S/C11H15NO2/c1-3-5-9-6-7-12-8-10(9)11(13)14-4-2/h6-8H,3-5H2,1-2H3
InChIKey MXPISRLJXUZZOQ-UHFFFAOYSA-N
Molecular Weight 193.246 g/mol
SMILES c1(C(=O)OCC)c(CCC)ccnc1
SPLASH splash10-00kf-2900000000-6abb3656fc316e3ec371
Source of Spectrum I-65-1888-11
Wiley ID 1189681