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2-[3-keto-2-(2-pyridyl)cyclohexen-1-yl]acetic acid methyl ester
SpectraBase Compound ID FW9Bm9syNwp
InChI InChI=1S/C14H15NO3/c1-18-13(17)9-10-5-4-7-12(16)14(10)11-6-2-3-8-15-11/h2-3,6,8H,4-5,7,9H2,1H3
InChIKey DTQQHCKSEKNXAO-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C14H15NO3
Exact Mass 245.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnurgJBlxBD
Name 2-[3-keto-2-(2-pyridyl)cyclohexen-1-yl]acetic acid methyl ester
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Formula C14H15NO3
InChI InChI=1S/C14H15NO3/c1-18-13(17)9-10-5-4-7-12(16)14(10)11-6-2-3-8-15-11/h2-3,6,8H,4-5,7,9H2,1H3
InChIKey DTQQHCKSEKNXAO-UHFFFAOYSA-N
Molecular Weight 245.278 g/mol
SMILES C(CC1=C(C(CCC1)=O)c1ccccn1)(=O)OC
SPLASH splash10-000i-0930000000-3591243687fb599b6d3e
Source of Spectrum KC-57-1775-11
Synonyms 2-[3-oxo-2-(2-pyridinyl)-1-cyclohexenyl]acetic acid methyl ester Methyl 2-(3-oxidanylidene-2-pyridin-2-yl-cyclohexen-1-yl)ethanoate Methyl 2-(3-oxo-2-pyridin-2-ylcyclohexen-1-yl)acetate Methyl 2-[3-oxo-2-(2-pyridyl)cyclohexen-1-yl]acetate
Wiley ID 1623014