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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7d5W8TF7uDE
Name Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-[(2,4,5-trimethoxyphenyl)methyl]-, (.+-.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.204573033 u
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 C1=2C(N(C)CCC2C=C(C(=C1)OC)OC)CC=1C(=CC(=C(C1)OC)OC)OC