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6,7-Dimethoxy-1-methylisoquinoline-3-carboxylic acid
SpectraBase Compound ID AvQQJJc170m
InChI InChI=1S/C13H13NO4/c1-7-9-6-12(18-3)11(17-2)5-8(9)4-10(14-7)13(15)16/h4-6H,1-3H3,(H,15,16)
InChIKey RILXPEYKDBNEHV-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTk4lUwGB4n
Name 6,7-Dimethoxy-1-methylisoquinoline-3-carboxylic acid
Alternate Name(s) 6,7-dimethoxy-1-methyl-3-isoquinolinecarboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-7-9-6-12(18-3)11(17-2)5-8(9)4-10(14-7)13(15)16/h4-6H,1-3H3,(H,15,16)
InChIKey RILXPEYKDBNEHV-UHFFFAOYSA-N
Molecular Weight 247.250 g/mol
SMILES OC(c1nc(c2c(cc(c(c2)OC)OC)c1)C)=O
SPLASH splash10-0udi-0090000000-3f22548b221638a6d2de
Source of Spectrum SO-0-1202-19
Wiley ID 874090