![Isoquinoline, 6,7-dimethoxy-1-[3,4-dimethoxyphenyl]-](/api/spectrum/AYPmzK6TIW1/structure.png?h=300&w=458 "Isoquinoline, 6,7-dimethoxy-1-[3,4-dimethoxyphenyl]-")
| SpectraBase Compound ID | 1CNQK9A0P3i |
|---|---|
| InChI | InChI=1S/C19H19NO4/c1-21-15-6-5-13(10-16(15)22-2)19-14-11-18(24-4)17(23-3)9-12(14)7-8-20-19/h5-11H,1-4H3 |
| InChIKey | XLBJZQMOXSPWRG-UHFFFAOYSA-N |
| Mol Weight | 325.36 g/mol |
| Molecular Formula | C19H19NO4 |
| Exact Mass | 325.131408 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AYPmzK6TIW1 |
|---|---|
| Name | Isoquinoline, 6,7-dimethoxy-1-[3,4-dimethoxyphenyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.131408092 u |
| Formula | C19H19NO4 |
| InChI | InChI=1S/C19H19NO4/c1-21-15-6-5-13(10-16(15)22-2)19-14-11-18(24-4)17(23-3)9-12(14)7-8-20-19/h5-11H,1-4H3 |
| InChIKey | XLBJZQMOXSPWRG-UHFFFAOYSA-N |
| Molecular Weight | 325.364 g/mol |
| SMILES | C1(=CC(=CC=C1OC)C=1C2=CC(=C(C=C2C=CN1)OC)OC)OC |