| SpectraBase Spectrum ID |
6RQE1939wgx |
| Name |
D-Phenylalanine, 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 |
207.125928789 u |
| Formula |
C12H17NO2 |
| InChI |
InChI=1S/C12H17NO2/c1-13(2)11(12(14)15-3)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3 |
| InChIKey |
ZQUSOVOPGJCBDN-UHFFFAOYSA-N |
| Molecular Weight |
207.273 g/mol |
| SMILES |
C1(=CC=CC=C1)CC(N(C)C)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953763 |
