| SpectraBase Compound ID | 88NGlt6HHT |
|---|---|
| InChI | InChI=1S/C13H15NO4/c1-8(15)14-5-4-9-6-11(17-2)12(18-3)7-10(9)13(14)16/h6-7H,4-5H2,1-3H3 |
| InChIKey | IGGSGQSTPYRCTJ-UHFFFAOYSA-N |
| Mol Weight | 249.27 g/mol |
| Molecular Formula | C13H15NO4 |
| Exact Mass | 249.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KcATZ6SHDde |
|---|---|
| Name | 1,2,3,4-Tetrahydroisoquinolin-1-one, N-acetyl-6,7-dimethoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.100107963 u |
| Formula | C13H15NO4 |
| InChI | InChI=1S/C13H15NO4/c1-8(15)14-5-4-9-6-11(17-2)12(18-3)7-10(9)13(14)16/h6-7H,4-5H2,1-3H3 |
| InChIKey | IGGSGQSTPYRCTJ-UHFFFAOYSA-N |
| Molecular Weight | 249.266 g/mol |
| SMILES | C12=C(C=C(C(=C2)OC)OC)CCN(C1=O)C(=O)C |