| SpectraBase Compound ID | 27NQJQWM2Ri |
|---|---|
| InChI | InChI=1S/C16H21NO4/c1-5-20-14(18)13(11-12-9-7-6-8-10-12)17-15(19)21-16(2,3)4/h6-11H,5H2,1-4H3,(H,17,19)/b13-11+ |
| InChIKey | BNYDWUZDWSSJGZ-ACCUITESSA-N |
| Mol Weight | 291.35 g/mol |
| Molecular Formula | C16H21NO4 |
| Exact Mass | 291.147058 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Wv3TRyjNEV |
|---|---|
| Name | (E)-Ethyl 2-(tert-butoxycarbonylamino)-3-(phenyl)prop-2-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.147058156 u |
| Formula | C16H21NO4 |
| InChI | InChI=1S/C16H21NO4/c1-5-20-14(18)13(11-12-9-7-6-8-10-12)17-15(19)21-16(2,3)4/h6-11H,5H2,1-4H3,(H,17,19)/b13-11+ |
| InChIKey | BNYDWUZDWSSJGZ-ACCUITESSA-N |
| SMILES | C(N\C(C(=O)OCC)=C/C1=CC=CC=C1)(OC(C)(C)C)=O |