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Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-[(2,4,5-trimethoxyphenyl)methyl]-, (.+-.)-
SpectraBase Compound ID GE9HnWvO08R
InChI InChI=1S/C22H29NO5/c1-23-8-7-14-10-19(25-3)21(27-5)12-16(14)17(23)9-15-11-20(26-4)22(28-6)13-18(15)24-2/h10-13,17H,7-9H2,1-6H3
InChIKey PNUHIGKMRINUCD-UHFFFAOYSA-N
Mol Weight 387.48 g/mol
Molecular Formula C22H29NO5
Exact Mass 387.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BwOowxqOd9M
Name Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-[(2,4,5-trimethoxyphenyl)methyl]-, (.+-.)-
Alternate Name(s) 1,2,3,4-Tetrahydro-6,7-dimethoxy-2-methyl-1-(2,4,5-trimethoxybenzyl)isoquinoline 6,7-dimethoxy-2-methyl-1-(2,4,5-trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline
CAS Registry Number 111619-16-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO5
InChI InChI=1S/C22H29NO5/c1-23-8-7-14-10-19(25-3)21(27-5)12-16(14)17(23)9-15-11-20(26-4)22(28-6)13-18(15)24-2/h10-13,17H,7-9H2,1-6H3
InChIKey PNUHIGKMRINUCD-UHFFFAOYSA-N
Molecular Weight 387.476 g/mol
SMILES c12C(N(C)CCc2cc(c(c1)OC)OC)Cc1c(cc(c(c1)OC)OC)OC
SPLASH splash10-0a4i-0090000000-f1604e70bb12a7fb1879
Source of Spectrum KC-1987-679-6
Wiley ID 1363421