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N-(Methoxycarbonyl)-1-[4'-(methoxymethyl)-2',4'-dioxobutyl]-isoquinoline
SpectraBase Compound ID 2BkXmDjUXwg
InChI InChI=1S/C17H19NO5/c1-22-11-14(20)9-13(19)10-16-15-6-4-3-5-12(15)7-8-18(16)17(21)23-2/h3-8,16H,9-11H2,1-2H3
InChIKey FEXPHFQKYBBUNZ-UHFFFAOYSA-N
Mol Weight 317.34 g/mol
Molecular Formula C17H19NO5
Exact Mass 317.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5jJaLiY8Q8q
Name N-(Methoxycarbonyl)-1-[4'-(methoxymethyl)-2',4'-dioxobutyl]-isoquinoline
Alternate Name(s) Methyl 1-(5-methoxy-2,4-dioxopentyl)-2(1H)-isoquinolinecarboxylate
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Formula C17H19NO5
InChI InChI=1S/C17H19NO5/c1-22-11-14(20)9-13(19)10-16-15-6-4-3-5-12(15)7-8-18(16)17(21)23-2/h3-8,16H,9-11H2,1-2H3
InChIKey FEXPHFQKYBBUNZ-UHFFFAOYSA-N
Molecular Weight 317.341 g/mol
SMILES C1(N(C=Cc2ccccc12)C(=O)OC)CC(CC(=O)COC)=O
SPLASH splash10-000i-0900000000-378dcf5c9a98d21c48d2
Source of Spectrum HE-2005-2491-3
Wiley ID 1613832