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7-Ethoxy-1-cyano-6-methylisoquinolin-5,8-dione
SpectraBase Compound ID E7skK9xqYh3
InChI InChI=1S/C13H10N2O3/c1-3-18-13-7(2)11(16)8-4-5-15-9(6-14)10(8)12(13)17/h4-5H,3H2,1-2H3
InChIKey WRLIFLWSSSRSMT-UHFFFAOYSA-N
Mol Weight 242.23 g/mol
Molecular Formula C13H10N2O3
Exact Mass 242.069142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlqToj7GBzE
Name 7-Ethoxy-1-cyano-6-methylisoquinolin-5,8-dione
Alternate Name(s) 7-Ethoxy-6-methyl-5,8-dioxo-5,8-dihydro-1-isoquinolinecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N2O3
InChI InChI=1S/C13H10N2O3/c1-3-18-13-7(2)11(16)8-4-5-15-9(6-14)10(8)12(13)17/h4-5H,3H2,1-2H3
InChIKey WRLIFLWSSSRSMT-UHFFFAOYSA-N
Molecular Weight 242.234 g/mol
SMILES c1(nccc2C(C(=C(C(c12)=O)OCC)C)=O)C#N
SPLASH splash10-0006-0960000000-8624bd019d22bd1d1085
Source of Spectrum O1-63-2361-19
Wiley ID 1592906