| SpectraBase Spectrum ID |
AUMrCEOYjJG |
| Name |
N-(Chloroacetyl)-N,2-diphenylglycine, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.097521141 u |
| Formula |
C18H18ClNO3 |
| InChI |
InChI=1S/C18H18ClNO3/c1-2-23-18(22)17(14-9-5-3-6-10-14)20(16(21)13-19)15-11-7-4-8-12-15/h3-12,17H,2,13H2,1H3 |
| InChIKey |
YQODBOCVUGURPD-UHFFFAOYSA-N |
| Molecular Weight |
331.799 g/mol |
| SMILES |
C(Cl)C(N(C=1C=CC=CC1)C(C=1C=CC=CC1)C(=O)OCC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.95135 |
