SpectraBase Spectrum ID |
KgqqMDWBDpT |
Name |
1-Naphthalenecarboxamide, N-(3-chlorophenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
281.060741709 u |
Formula |
C17H12ClNO |
InChI |
InChI=1S/C17H12ClNO/c18-13-7-4-8-14(11-13)19-17(20)16-10-3-6-12-5-1-2-9-15(12)16/h1-11H,(H,19,20) |
InChIKey |
MROMMCULOKJDLK-UHFFFAOYSA-N |
SMILES |
C1=CC2=C(C(=C1)C(NC1=CC(=CC=C1)Cl)=O)C=CC=C2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917085 |