| SpectraBase Spectrum ID |
GOcVbLOnyCH |
| Name |
Methyl N-(phenylglyoxyl)valinate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
263.115758027 u |
| Formula |
C14H17NO4 |
| InChI |
InChI=1S/C14H17NO4/c1-9(2)11(14(18)19-3)15-13(17)12(16)10-7-5-4-6-8-10/h4-9,11H,1-3H3,(H,15,17) |
| InChIKey |
LIEGURDVQMKRKT-UHFFFAOYSA-N |
| Molecular Weight |
263.293 g/mol |
| SMILES |
C(NC(C(=O)OC)C(C)C)(C(=O)C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.981164 |