| SpectraBase Compound ID | BOz5dGLYGif |
|---|---|
| InChI | InChI=1S/C12H17NO2/c1-4-15-11(14)8-13-12-9(2)6-5-7-10(12)3/h5-7,13H,4,8H2,1-3H3 |
| InChIKey | PCBMYWORBGOYHM-UHFFFAOYSA-N |
| Mol Weight | 207.27 g/mol |
| Molecular Formula | C12H17NO2 |
| Exact Mass | 207.125929 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3sGkle4YC5s |
|---|---|
| Name | Glycine, N-(2,6-dimethylphenyl)-, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.125928789 u |
| Formula | C12H17NO2 |
| InChI | InChI=1S/C12H17NO2/c1-4-15-11(14)8-13-12-9(2)6-5-7-10(12)3/h5-7,13H,4,8H2,1-3H3 |
| InChIKey | PCBMYWORBGOYHM-UHFFFAOYSA-N |
| Molecular Weight | 207.273 g/mol |
| SMILES | N(C1=C(C=CC=C1C)C)CC(OCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.957474 |