| SpectraBase Compound ID | F1trYgfZNNb |
|---|---|
| InChI | InChI=1S/C16H21NO7/c1-4-22-15(19)17-13(14(18)21-3)10-11-6-8-12(9-7-11)24-16(20)23-5-2/h6-9,13H,4-5,10H2,1-3H3,(H,17,19) |
| InChIKey | JAFILHGGUABKSO-UHFFFAOYSA-N |
| Mol Weight | 339.34 g/mol |
| Molecular Formula | C16H21NO7 |
| Exact Mass | 339.131802 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D4jiWPiEDBl |
|---|---|
| Name | L-Tyrosine, N,o-bis(ethoxycarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.131802013 u |
| Formula | C16H21NO7 |
| InChI | InChI=1S/C16H21NO7/c1-4-22-15(19)17-13(14(18)21-3)10-11-6-8-12(9-7-11)24-16(20)23-5-2/h6-9,13H,4-5,10H2,1-3H3,(H,17,19) |
| InChIKey | JAFILHGGUABKSO-UHFFFAOYSA-N |
| Molecular Weight | 339.344 g/mol |
| SMILES | C(CC1=CC=C(C=C1)OC(OCC)=O)(C(OC)=O)NC(OCC)=O |