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4-Isoquinolinecarboxylic acid, 3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-, methyl ester
SpectraBase Compound ID 4okltqnin9l
InChI InChI=1S/C20H17NO6/c1-23-15-7-12-9-21-19(11-4-5-14-17(6-11)27-10-26-14)18(20(22)25-3)13(12)8-16(15)24-2/h4-9H,10H2,1-3H3
InChIKey HXKWLKYRFXCGHL-UHFFFAOYSA-N
Mol Weight 367.36 g/mol
Molecular Formula C20H17NO6
Exact Mass 367.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HneiYlc5rkQ
Name 4-Isoquinolinecarboxylic acid, 3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-, methyl ester
Alternate Name(s) 4-Carbomethoxy-6,7-dimethoxy-3(3',4'-methylenedioxyphenyl)-isoquinoline Methyl 3-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-4-isoquinolinecarboxylate
CAS Registry Number 110694-92-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17NO6
InChI InChI=1S/C20H17NO6/c1-23-15-7-12-9-21-19(11-4-5-14-17(6-11)27-10-26-14)18(20(22)25-3)13(12)8-16(15)24-2/h4-9H,10H2,1-3H3
InChIKey HXKWLKYRFXCGHL-UHFFFAOYSA-N
Molecular Weight 367.357 g/mol
SMILES c1(c2cc(OC)c(cc2cnc1-c1cc2OCOc2cc1)OC)C(=O)OC
SPLASH splash10-0gb9-0009000000-528a8ac5c99f85bbe6a0
Source of Spectrum I-65-20-9
Wiley ID 1352535