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(+-)-Acetic acid 1-(isoquinolin-3-yl)ethyl ester
SpectraBase Compound ID 8e6JeUfsNCC
InChI InChI=1S/C13H13NO2/c1-9(16-10(2)15)13-7-11-5-3-4-6-12(11)8-14-13/h3-9H,1-2H3
InChIKey FMALANGQUMIFIJ-UHFFFAOYSA-N
Mol Weight 215.25 g/mol
Molecular Formula C13H13NO2
Exact Mass 215.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BV0TX5JdFgJ
Name (+-)-Acetic acid 1-(isoquinolin-3-yl)ethyl ester
Alternate Name(s) 1-(3-isoquinolinyl)ethyl acetate Acetic acid 1-(3-isoquinolinyl)ethyl ester 1-isoquinolin-3-ylethyl acetate 1-(3-isoquinolyl)ethyl acetate 1-isoquinolin-3-ylethyl ethanoate
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Formula C13H13NO2
InChI InChI=1S/C13H13NO2/c1-9(16-10(2)15)13-7-11-5-3-4-6-12(11)8-14-13/h3-9H,1-2H3
InChIKey FMALANGQUMIFIJ-UHFFFAOYSA-N
Molecular Weight 215.252 g/mol
SMILES C(C)(=O)OC(C)c1ncc2c(c1)cccc2
SPLASH splash10-00di-1900000000-557d8f46705e58cc09ed
Source of Spectrum KD-12-1195-10
Wiley ID 1634377