![Methyl 2-{[8-(dimethylamino)naphthalen-1-yl]amino}propanoate](/api/spectrum/88Pfi8R4rzM/structure.png?h=300&w=458 "Methyl 2-{[8-(dimethylamino)naphthalen-1-yl]amino}propanoate")
| SpectraBase Compound ID | LqLA9tItGps |
|---|---|
| InChI | InChI=1S/C16H20N2O2/c1-11(16(19)20-4)17-13-9-5-7-12-8-6-10-14(15(12)13)18(2)3/h5-11,17H,1-4H3 |
| InChIKey | GXKQXXWHVJFHNL-UHFFFAOYSA-N |
| Mol Weight | 272.35 g/mol |
| Molecular Formula | C16H20N2O2 |
| Exact Mass | 272.152478 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 88Pfi8R4rzM |
|---|---|
| Name | Methyl 2-{[8-(dimethylamino)naphthalen-1-yl]amino}propanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.152477890 u |
| Formula | C16H20N2O2 |
| InChI | InChI=1S/C16H20N2O2/c1-11(16(19)20-4)17-13-9-5-7-12-8-6-10-14(15(12)13)18(2)3/h5-11,17H,1-4H3 |
| InChIKey | GXKQXXWHVJFHNL-UHFFFAOYSA-N |
| Molecular Weight | 272.348 g/mol |
| SMILES | C1=C2C(=C(C=C1)NC(C)C(OC)=O)C(=CC=C2)N(C)C |