| SpectraBase Compound ID | 1b7xcwAmAFQ |
|---|---|
| InChI | InChI=1S/C16H17NO2/c18-15-9-12-6-7-17-14(13(12)10-16(15)19)8-11-4-2-1-3-5-11/h1-5,9-10,14,17-19H,6-8H2 |
| InChIKey | GGGSEBXTKMTNBW-UHFFFAOYSA-N |
| Mol Weight | 255.32 g/mol |
| Molecular Formula | C16H17NO2 |
| Exact Mass | 255.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KdWD7weLtmN |
|---|---|
| Name | 1,2,3,4-Tetrahydroisoquinolin-6,7-diol, 1-benzyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.125928789 u |
| Formula | C16H17NO2 |
| InChI | InChI=1S/C16H17NO2/c18-15-9-12-6-7-17-14(13(12)10-16(15)19)8-11-4-2-1-3-5-11/h1-5,9-10,14,17-19H,6-8H2 |
| InChIKey | GGGSEBXTKMTNBW-UHFFFAOYSA-N |
| Molecular Weight | 255.317 g/mol |
| SMILES | C1(=C(C=C2C(=C1)C(NCC2)CC1=CC=CC=C1)O)O |