SpectraBase Spectrum ID |
22d2YHT3Uuk |
Name |
2-Amino-4'-chlorobenzophenone, N-(2-methylpropionyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
301.086956457 u |
Formula |
C17H16ClNO2 |
InChI |
InChI=1S/C17H16ClNO2/c1-11(2)17(21)19-15-6-4-3-5-14(15)16(20)12-7-9-13(18)10-8-12/h3-11H,1-2H3,(H,19,21) |
InChIKey |
QBNNCUXPTZWGJF-UHFFFAOYSA-N |
SMILES |
C1(Cl)=CC=C(C=C1)C(=O)C1=C(C=CC=C1)NC(C(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902936 |