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2(1H)-Isoquinolinecarboxylic acid, 4-[(3,4-dimethoxyphenyl)methyl]-3,4-dihydro-6,7-dimethoxy-, ethyl ester, (.+-.)-
SpectraBase Compound ID AUv4n5O9Eeq
InChI InChI=1S/C23H29NO6/c1-6-30-23(25)24-13-16(9-15-7-8-19(26-2)20(10-15)27-3)18-12-22(29-5)21(28-4)11-17(18)14-24/h7-8,10-12,16H,6,9,13-14H2,1-5H3
InChIKey POHHDGWVBNCTBZ-UHFFFAOYSA-N
Mol Weight 415.49 g/mol
Molecular Formula C23H29NO6
Exact Mass 415.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCHqbKyM1rK
Name 2(1H)-Isoquinolinecarboxylic acid, 4-[(3,4-dimethoxyphenyl)methyl]-3,4-dihydro-6,7-dimethoxy-, ethyl ester, (.+-.)-
CAS Registry Number 98748-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO6
InChI InChI=1S/C23H29NO6/c1-6-30-23(25)24-13-16(9-15-7-8-19(26-2)20(10-15)27-3)18-12-22(29-5)21(28-4)11-17(18)14-24/h7-8,10-12,16H,6,9,13-14H2,1-5H3
InChIKey POHHDGWVBNCTBZ-UHFFFAOYSA-N
Molecular Weight 415.486 g/mol
SMILES C(N1Cc2cc(OC)c(cc2C(C1)Cc1cc(OC)c(cc1)OC)OC)(=O)OCC
SPLASH splash10-03di-0290000000-889c5fefee407fc7a6e3
Source of Spectrum KC-1985-1199-0
Synonyms 4-(3,4-Dimethoxybenzyl)-2-ethoxycarbonyl-1,2,3,4-tetrahydro-6,7-dimethoxyisoquinoline Ethyl 4-(3,4-dimethoxybenzyl)-6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinecarboxylate
Wiley ID 1376005