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3-Ethoxycarbonyl-5,8-dihydro-7-methoxy-1,6-dimethylisoquinoline-5,8-dione
SpectraBase Compound ID 6XCTihNf7bP
InChI InChI=1S/C15H15NO5/c1-5-21-15(19)10-6-9-11(8(3)16-10)13(18)14(20-4)7(2)12(9)17/h6H,5H2,1-4H3
InChIKey SKNAVJQRSZFNLQ-UHFFFAOYSA-N
Mol Weight 289.29 g/mol
Molecular Formula C15H15NO5
Exact Mass 289.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H4LcWpSHWso
Name 3-Ethoxycarbonyl-5,8-dihydro-7-methoxy-1,6-dimethylisoquinoline-5,8-dione
Alternate Name(s) ethyl 7-methoxy-1,6-dimethyl-5,8-dioxo-5,8-dihydro-3-isoquinolinecarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C15H15NO5
InChI InChI=1S/C15H15NO5/c1-5-21-15(19)10-6-9-11(8(3)16-10)13(18)14(20-4)7(2)12(9)17/h6H,5H2,1-4H3
InChIKey SKNAVJQRSZFNLQ-UHFFFAOYSA-N
Molecular Weight 289.287 g/mol
SMILES C1(c2c(cc(nc2C)C(=O)OCC)C(C(=C1OC)C)=O)=O
SPLASH splash10-014i-0090000000-2aeb37ae506267fe3c5c
Source of Spectrum SO-0-965-14
Wiley ID 874724