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2-[4-(2-cyanoethyl)-3-pyridinyl]acetic acid ethyl ester
SpectraBase Compound ID HjnGbhErWvO
InChI InChI=1S/C12H14N2O2/c1-2-16-12(15)8-11-9-14-7-5-10(11)4-3-6-13/h5,7,9H,2-4,8H2,1H3
InChIKey SJILPKTYIKNWPK-UHFFFAOYSA-N
Mol Weight 218.26 g/mol
Molecular Formula C12H14N2O2
Exact Mass 218.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PIGcN3t73M
Name 2-[4-(2-cyanoethyl)-3-pyridinyl]acetic acid ethyl ester
Alternate Name(s) 2-[4-(2-cyanoethyl)-3-pyridyl]acetic acid ethyl ester Ethyl 2-[4-(2-cyanoethyl)-3-pyridyl]acetate Ethyl 2-[4-(2-cyanoethyl)pyridin-3-yl]acetate Ethyl 2-[4-(2-cyanoethyl)pyridin-3-yl]ethanoate
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Formula C12H14N2O2
InChI InChI=1S/C12H14N2O2/c1-2-16-12(15)8-11-9-14-7-5-10(11)4-3-6-13/h5,7,9H,2-4,8H2,1H3
InChIKey SJILPKTYIKNWPK-UHFFFAOYSA-N
Molecular Weight 218.256 g/mol
SMILES C(#N)CCc1c(CC(=O)OCC)cncc1
SPLASH splash10-014i-0920000000-53060af56e87194af66d
Source of Spectrum J-58-3163-4
Wiley ID 1217577