| SpectraBase Compound ID | BiXikxSUCKp |
|---|---|
| InChI | InChI=1S/C15H19NO4/c1-4-20-15(19)16-14(12-8-6-5-7-9-12)13(10(2)17)11(3)18/h5-9,13-14H,4H2,1-3H3,(H,16,19) |
| InChIKey | CIRSUKQCGDSERL-UHFFFAOYSA-N |
| Mol Weight | 277.32 g/mol |
| Molecular Formula | C15H19NO4 |
| Exact Mass | 277.131408 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5WB916gRJ6T |
|---|---|
| Name | Carbamic acid, (2-acetyl-3-oxo-1-phenylbutyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.131408092 u |
| Formula | C15H19NO4 |
| InChI | InChI=1S/C15H19NO4/c1-4-20-15(19)16-14(12-8-6-5-7-9-12)13(10(2)17)11(3)18/h5-9,13-14H,4H2,1-3H3,(H,16,19) |
| InChIKey | CIRSUKQCGDSERL-UHFFFAOYSA-N |
| Molecular Weight | 277.320 g/mol |
| SMILES | N(C(C(C(=O)C)C(=O)C)C1=CC=CC=C1)C(=O)OCC |