| SpectraBase Compound ID | 4tXJE5XSrxw |
|---|---|
| InChI | InChI=1S/C13H17NO3/c1-3-14(9-13(16)17-4-2)12-7-5-11(10-15)6-8-12/h5-8,10H,3-4,9H2,1-2H3 |
| InChIKey | DJZJPZIVQMAPFA-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 | 96A6UEtkIA8 |
|---|---|
| Name | Glycine, N-ethyl-N-(4-formylphenyl)-, ethyl 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/c1-3-14(9-13(16)17-4-2)12-7-5-11(10-15)6-8-12/h5-8,10H,3-4,9H2,1-2H3 |
| InChIKey | DJZJPZIVQMAPFA-UHFFFAOYSA-N |
| Molecular Weight | 235.283 g/mol |
| SMILES | CCOC(=O)CN(CC)C1=CC=C(C=C1)C=O |