| SpectraBase Spectrum ID |
DN1l3RIv66P |
| Name |
L-Tyrosine, N-(methoxycarbonyl)-, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
253.095022582 u |
| Formula |
C12H15NO5 |
| InChI |
InChI=1S/C12H15NO5/c1-17-11(15)10(13-12(16)18-2)7-8-3-5-9(14)6-4-8/h3-6,10,14H,7H2,1-2H3,(H,13,16) |
| InChIKey |
YLGQFWNMUMBQSI-UHFFFAOYSA-N |
| Molecular Weight |
253.254 g/mol |
| SMILES |
C(C(NC(=O)OC)CC1=CC=C(C=C1)O)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937609 |
