| SpectraBase Compound ID | 2xb8YBvgDpm |
|---|---|
| InChI | InChI=1S/C11H17NO2.C2H4O2/c1-12-7-6-9-4-5-10(13-2)11(8-9)14-3;1-2(3)4/h4-5,8,12H,6-7H2,1-3H3;1H3,(H,3,4) |
| InChIKey | NHJQVXADHZBFSP-UHFFFAOYSA-N |
| Mol Weight | 255.31 g/mol |
| Molecular Formula | C13H21NO4 |
| Exact Mass | 255.147058 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JR6z7HXxoLL |
|---|---|
| Name | N-Methyl-2-(3,4-dimethoxyphenyl)ethylamine acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.147058156 u |
| Formula | C13H21NO4 |
| InChI | InChI=1S/C11H17NO2.C2H4O2/c1-12-7-6-9-4-5-10(13-2)11(8-9)14-3;1-2(3)4/h4-5,8,12H,6-7H2,1-3H3;1H3,(H,3,4) |
| InChIKey | NHJQVXADHZBFSP-UHFFFAOYSA-N |
| Molecular Weight | 255.314 g/mol |
| SMILES | C(=O)(O)C.C=1(C(=CC=C(C1)CCNC)OC)OC |