![Ethyl {[2-(4-methylphenyl)-2-oxoethyl]carbamoyl}formate](/api/spectrum/3P02tMzdV2Y/structure.png?h=300&w=458 "Ethyl {[2-(4-methylphenyl)-2-oxoethyl]carbamoyl}formate")
| SpectraBase Compound ID | PmDTNOm9Hd |
|---|---|
| InChI | InChI=1S/C13H15NO4/c1-3-18-13(17)12(16)14-8-11(15)10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3,(H,14,16) |
| InChIKey | FVCDKACAVXOSNQ-UHFFFAOYSA-N |
| Mol Weight | 249.27 g/mol |
| Molecular Formula | C13H15NO4 |
| Exact Mass | 249.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3P02tMzdV2Y |
|---|---|
| Name | Ethyl {[2-(4-methylphenyl)-2-oxoethyl]carbamoyl}formate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.100107963 u |
| Formula | C13H15NO4 |
| InChI | InChI=1S/C13H15NO4/c1-3-18-13(17)12(16)14-8-11(15)10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3,(H,14,16) |
| InChIKey | FVCDKACAVXOSNQ-UHFFFAOYSA-N |
| Molecular Weight | 249.266 g/mol |
| SMILES | C(C(=O)OCC)(NCC(C=1C=CC(C)=CC1)=O)=O |