| SpectraBase Compound ID | CimdTCvhgSs |
|---|---|
| InChI | InChI=1S/C12H15NO3/c1-9(14)8-16-12(15)10-4-6-11(7-5-10)13(2)3/h4-7H,8H2,1-3H3 |
| InChIKey | OUUJBOOJGBSMIF-UHFFFAOYSA-N |
| Mol Weight | 221.26 g/mol |
| Molecular Formula | C12H15NO3 |
| Exact Mass | 221.105193 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jwl5slvPT0X |
|---|---|
| Name | Benzoic acid, 4-(dimethylamino)-, 2-oxopropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.105193344 u |
| Formula | C12H15NO3 |
| InChI | InChI=1S/C12H15NO3/c1-9(14)8-16-12(15)10-4-6-11(7-5-10)13(2)3/h4-7H,8H2,1-3H3 |
| InChIKey | OUUJBOOJGBSMIF-UHFFFAOYSA-N |
| Molecular Weight | 221.256 g/mol |
| SMILES | C1=C(C=CC(=C1)N(C)C)C(OCC(C)=O)=O |