| SpectraBase Compound ID | 7UtwV0KA7op |
|---|---|
| InChI | InChI=1S/C16H21NO4/c1-5-14(19)17-12-8-6-11(7-9-12)15(20)21-10-13(18)16(2,3)4/h6-9H,5,10H2,1-4H3,(H,17,19) |
| InChIKey | WFKAOMPQMCYYPC-UHFFFAOYSA-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 | L09jjMFtxg8 |
|---|---|
| Name | 3,3-Dimethyl-2-oxobutyl 4-(propionylamino)benzoate |
| 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/c1-5-14(19)17-12-8-6-11(7-9-12)15(20)21-10-13(18)16(2,3)4/h6-9H,5,10H2,1-4H3,(H,17,19) |
| InChIKey | WFKAOMPQMCYYPC-UHFFFAOYSA-N |
| SMILES | N(C(=O)CC)C=1C=CC(C(OCC(C(C)(C)C)=O)=O)=CC1 |