![7-Isoquinolinol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-, (S)-](/api/spectrum/JRjPL9RPIFv/structure.png?h=300&w=458 "7-Isoquinolinol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-, (S)-")
| SpectraBase Compound ID | EZ6ClI4j7ds |
|---|---|
| InChI | InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3 |
| InChIKey | LVVKXRQZSRUVPY-UHFFFAOYSA-N |
| Mol Weight | 285.34 g/mol |
| Molecular Formula | C17H19NO3 |
| Exact Mass | 285.136493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JRjPL9RPIFv |
|---|---|
| Name | 7-Isoquinolinol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-, (S)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.136493473 u |
| Formula | C17H19NO3 |
| InChI | InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3 |
| InChIKey | LVVKXRQZSRUVPY-UHFFFAOYSA-N |
| SMILES | C1(O)=CC=C(C=C1)CC1C2=C(C=C(OC)C(O)=C2)CCN1 |