| SpectraBase Compound ID | 3HgkcuPnP12 |
|---|---|
| InChI | InChI=1S/C14H20N2O2/c1-16(2)11-15-13(10-14(17)18-3)9-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3/b15-11+ |
| InChIKey | XEXIYJWBCDYJSK-RVDMUPIBSA-N |
| Mol Weight | 248.33 g/mol |
| Molecular Formula | C14H20N2O2 |
| Exact Mass | 248.152478 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Clk4FZCto6 |
|---|---|
| Name | dl-.beta.-Homophenylalanine, N-dimethylaminomethylene-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.152477890 u |
| Formula | C14H20N2O2 |
| InChI | InChI=1S/C14H20N2O2/c1-16(2)11-15-13(10-14(17)18-3)9-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3/b15-11+ |
| InChIKey | XEXIYJWBCDYJSK-RVDMUPIBSA-N |
| Molecular Weight | 248.326 g/mol |
| SMILES | C1=C(C=CC=C1)CC(\N=C\N(C)C)CC(=O)OC |