| SpectraBase Compound ID | IL4tgEkR8Qm |
|---|---|
| InChI | InChI=1S/C13H17NO3/c1-2-10-17-13(16)12(15)14-9-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,14,15) |
| InChIKey | NVPPOQOROQBSRT-UHFFFAOYSA-N |
| Mol Weight | 235.28 g/mol |
| Molecular Formula | C13H17NO3 |
| Exact Mass | 235.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 95Kq6ec1gAP |
|---|---|
| Name | Oxalic acid, monoamide, N-(2-phenylethyl)-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.120843408 u |
| Formula | C13H17NO3 |
| InChI | InChI=1S/C13H17NO3/c1-2-10-17-13(16)12(15)14-9-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,14,15) |
| InChIKey | NVPPOQOROQBSRT-UHFFFAOYSA-N |
| Molecular Weight | 235.283 g/mol |
| SMILES | C(C(OCCC)=O)(=O)NCCC1=CC=CC=C1 |