| SpectraBase Compound ID | F2h4oLTmrJJ |
|---|---|
| InChI | InChI=1S/C11H13NO2/c13-11(14)7-10-9-4-2-1-3-8(9)5-6-12-10/h1-4,10,12H,5-7H2,(H,13,14) |
| InChIKey | BUAVPRGEIAVFBF-UHFFFAOYSA-N |
| Mol Weight | 191.23 g/mol |
| Molecular Formula | C11H13NO2 |
| Exact Mass | 191.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 990P6pU363v |
|---|---|
| Name | 1,2,3,4-Tetrahydroisoquinolin-1-ylacetic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.094628661 u |
| Formula | C11H13NO2 |
| InChI | InChI=1S/C11H13NO2/c13-11(14)7-10-9-4-2-1-3-8(9)5-6-12-10/h1-4,10,12H,5-7H2,(H,13,14) |
| InChIKey | BUAVPRGEIAVFBF-UHFFFAOYSA-N |
| Molecular Weight | 191.230 g/mol |
| SMILES | C1=C2C(C(NCC2)CC(O)=O)=CC=C1 |