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(+-)-Acetic acid 1-(isoquinolin-3-yl)prop-2-ynyl ester
SpectraBase Compound ID F5kLmtLareH
InChI InChI=1S/C14H11NO2/c1-3-14(17-10(2)16)13-8-11-6-4-5-7-12(11)9-15-13/h1,4-9,14H,2H3
InChIKey KMEILZPHGJUDLS-UHFFFAOYSA-N
Mol Weight 225.25 g/mol
Molecular Formula C14H11NO2
Exact Mass 225.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1lN7U7hGn0
Name (+-)-Acetic acid 1-(isoquinolin-3-yl)prop-2-ynyl ester
Alternate Name(s) 1-(3-isoquinolinyl)-2-propynyl acetate
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Formula C14H11NO2
InChI InChI=1S/C14H11NO2/c1-3-14(17-10(2)16)13-8-11-6-4-5-7-12(11)9-15-13/h1,4-9,14H,2H3
InChIKey KMEILZPHGJUDLS-UHFFFAOYSA-N
Molecular Weight 225.247 g/mol
SMILES c1(ncc2c(c1)cccc2)C(C#C)OC(=O)C
SPLASH splash10-001i-0900000000-879ff68c9f8bbaaa4e38
Source of Spectrum KD-12-1196-10
Wiley ID 1634372