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1,2-Dihydro-6,7-dimethoxy-2-methyl-veratrylisoquinoline

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

1,2-Dihydro-6,7-dimethoxy-2-methyl-veratrylisoquinoline
SpectraBase Compound ID FuO9oh2haJE
InChI InChI=1S/C21H25NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-9,11-13,17H,10H2,1-5H3
InChIKey JTPHLUJGSNTOFP-UHFFFAOYSA-N
Mol Weight 355.43 g/mol
Molecular Formula C21H25NO4
Exact Mass 355.178358 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 2ZKbxsONSp7
Name 1,2-Dihydro-6,7-dimethoxy-2-methyl-veratrylisoquinoline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.178358285 u
Formula C21H25NO4
InChI InChI=1S/C21H25NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-9,11-13,17H,10H2,1-5H3
InChIKey JTPHLUJGSNTOFP-UHFFFAOYSA-N
Molecular Weight 355.434 g/mol
SMILES C=12C=C(C(=CC1C(N(C=C2)C)CC=1C=CC(=C(C1)OC)OC)OC)OC
Spectrum/Structure Validation Score (Raman) 0.922323