SpectraBase Spectrum ID |
JIYK4XKkwfe |
Name |
Benzophenone, 5-chloro-2-[N-[N-acetylamino]acetylamino]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
330.077120048 u |
Formula |
C17H15ClN2O3 |
InChI |
InChI=1S/C17H15ClN2O3/c1-11(21)19-10-16(22)20-15-8-7-13(18)9-14(15)17(23)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,21)(H,20,22) |
InChIKey |
QQLRBTUJCHSQFM-UHFFFAOYSA-N |
Molecular Weight |
330.771 g/mol |
SMILES |
C1(=C(C=CC(=C1)Cl)NC(CNC(C)=O)=O)C(=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.985134 |