| SpectraBase Compound ID | 9CEVJ25R5tj |
|---|---|
| InChI | InChI=1S/C12H17NO3/c1-3-16-12(14)11(13)8-9-4-6-10(15-2)7-5-9/h4-7,11H,3,8,13H2,1-2H3 |
| InChIKey | GRDSNVUGGUKPKE-UHFFFAOYSA-N |
| Mol Weight | 223.27 g/mol |
| Molecular Formula | C12H17NO3 |
| Exact Mass | 223.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CwEp9C0Vm9H |
|---|---|
| Name | L-Tyrosine, o-methyl-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.120843408 u |
| Formula | C12H17NO3 |
| InChI | InChI=1S/C12H17NO3/c1-3-16-12(14)11(13)8-9-4-6-10(15-2)7-5-9/h4-7,11H,3,8,13H2,1-2H3 |
| InChIKey | GRDSNVUGGUKPKE-UHFFFAOYSA-N |
| Molecular Weight | 223.272 g/mol |
| SMILES | C1(=CC=C(C=C1)OC)CC(C(=O)OCC)N |