![Methyl 3-[benzyl(2-methyl-2-propenyl)amino]propanoate](/api/spectrum/xXvWXuI5XP/structure.png?h=300&w=458 "Methyl 3-[benzyl(2-methyl-2-propenyl)amino]propanoate")
| SpectraBase Compound ID | 18XCQrTP83N |
|---|---|
| InChI | InChI=1S/C15H21NO2/c1-13(2)11-16(10-9-15(17)18-3)12-14-7-5-4-6-8-14/h4-8H,1,9-12H2,2-3H3 |
| InChIKey | QUARGKSNEQAEBT-UHFFFAOYSA-N |
| Mol Weight | 247.34 g/mol |
| Molecular Formula | C15H21NO2 |
| Exact Mass | 247.157229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | xXvWXuI5XP |
|---|---|
| Name | Methyl 3-[benzyl(2-methyl-2-propenyl)amino]propanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.157228918 u |
| Formula | C15H21NO2 |
| InChI | InChI=1S/C15H21NO2/c1-13(2)11-16(10-9-15(17)18-3)12-14-7-5-4-6-8-14/h4-8H,1,9-12H2,2-3H3 |
| InChIKey | QUARGKSNEQAEBT-UHFFFAOYSA-N |
| Molecular Weight | 247.338 g/mol |
| SMILES | C(CCN(CC(=C)C)CC1=CC=CC=C1)(=O)OC |