| SpectraBase Compound ID | ICyRryyYcEU |
|---|---|
| InChI | InChI=1S/C15H21NO4/c1-5-20-15(18)14(16(3)11(2)17)10-12-6-8-13(19-4)9-7-12/h6-9,14H,5,10H2,1-4H3 |
| InChIKey | XZHKLDFRDYKTHP-UHFFFAOYSA-N |
| Mol Weight | 279.34 g/mol |
| Molecular Formula | C15H21NO4 |
| Exact Mass | 279.147058 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EmwBbtTAPgv |
|---|---|
| Name | N-Acetyl-N-methyl-L-tyrosine, methyl ether, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.147058156 u |
| Formula | C15H21NO4 |
| InChI | InChI=1S/C15H21NO4/c1-5-20-15(18)14(16(3)11(2)17)10-12-6-8-13(19-4)9-7-12/h6-9,14H,5,10H2,1-4H3 |
| InChIKey | XZHKLDFRDYKTHP-UHFFFAOYSA-N |
| Molecular Weight | 279.336 g/mol |
| SMILES | C1(CC(C(OCC)=O)N(C(C)=O)C)=CC=C(C=C1)OC |