SpectraBase Spectrum ID |
3xuExNkJE2N |
Name |
N-(2-Chlorobenzyl)-N'-o-phenetyl-oxamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
332.092770112 u |
Formula |
C17H17ClN2O3 |
InChI |
InChI=1S/C17H17ClN2O3/c1-2-23-15-10-6-5-9-14(15)20-17(22)16(21)19-11-12-7-3-4-8-13(12)18/h3-10H,2,11H2,1H3,(H,19,21)(H,20,22) |
InChIKey |
BNNBBFIMYJOCNX-UHFFFAOYSA-N |
Molecular Weight |
332.787 g/mol |
SMILES |
C(NC1=C(OCC)C=CC=C1)(C(NCC1=C(Cl)C=CC=C1)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906592 |