| SpectraBase Spectrum ID |
AmktxXFRqzG |
| Name |
Glycine, N-(4-methylbenzoyl)-, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
207.089543280 u |
| Formula |
C11H13NO3 |
| InChI |
InChI=1S/C11H13NO3/c1-8-3-5-9(6-4-8)11(14)12-7-10(13)15-2/h3-6H,7H2,1-2H3,(H,12,14) |
| InChIKey |
OIBNTNKRKWKBQG-UHFFFAOYSA-N |
| Molecular Weight |
207.229 g/mol |
| SMILES |
C(=O)(C1=CC=C(C)C=C1)NCC(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918838 |
