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2-(3-Isoquinolinyl)-benzoic acid methyl ester
SpectraBase Compound ID LyAvLNuG1Eb
InChI InChI=1S/C17H13NO2/c1-20-17(19)15-9-5-4-8-14(15)16-10-12-6-2-3-7-13(12)11-18-16/h2-11H,1H3
InChIKey AJLPKFFVOWHNJV-UHFFFAOYSA-N
Mol Weight 263.3 g/mol
Molecular Formula C17H13NO2
Exact Mass 263.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EjyMPt3wiyL
Name 2-(3-Isoquinolinyl)-benzoic acid methyl ester
Alternate Name(s) Methyl 2-(isoquinolin-3-yl)benzoate
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Formula C17H13NO2
InChI InChI=1S/C17H13NO2/c1-20-17(19)15-9-5-4-8-14(15)16-10-12-6-2-3-7-13(12)11-18-16/h2-11H,1H3
InChIKey AJLPKFFVOWHNJV-UHFFFAOYSA-N
Molecular Weight 263.296 g/mol
SMILES c1ccc(c(c1)-c1ncc2c(c1)cccc2)C(OC)=O
SPLASH splash10-001i-0090000000-9df7d3cb1ff5be641e9e
Source of Spectrum APC-317-7-7b
Wiley ID 1788084