SpectraBase Spectrum ID |
J8rIOOWargd |
Name |
L-Tyrosine, o-(1,1-dimethylethyl)-N,N-dimethyl-, methyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
279.183443666 u |
Formula |
C16H25NO3 |
InChI |
InChI=1S/C16H25NO3/c1-16(2,3)20-13-9-7-12(8-10-13)11-14(17(4)5)15(18)19-6/h7-10,14H,11H2,1-6H3/t14-/m0/s1 |
InChIKey |
SFHKFAUIINDTFL-AWEZNQCLSA-N |
SMILES |
[C@@](N(C)C)(CC1=CC=C(C=C1)OC(C)(C)C)(C(=O)OC)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.822365 |