SpectraBase Spectrum ID |
GdNXQPFzztk |
Name |
Benzamide, 4-chloro-N-methallyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
209.060741709 u |
Formula |
C11H12ClNO |
InChI |
InChI=1S/C11H12ClNO/c1-8(2)7-13-11(14)9-3-5-10(12)6-4-9/h3-6H,1,7H2,2H3,(H,13,14) |
InChIKey |
QTCOKWSPEHQPEL-UHFFFAOYSA-N |
Molecular Weight |
209.676 g/mol |
SMILES |
C1=C(C=CC(=C1)Cl)C(=O)NCC(=C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913421 |