SpectraBase Spectrum ID |
A6farlUKvfV |
Name |
Oxalamide, N-[2-(4-chlorophenyl)ethyl]-N'-(2-fluorophenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
320.072783560 u |
Formula |
C16H14ClFN2O2 |
InChI |
InChI=1S/C16H14ClFN2O2/c17-12-7-5-11(6-8-12)9-10-19-15(21)16(22)20-14-4-2-1-3-13(14)18/h1-8H,9-10H2,(H,19,21)(H,20,22) |
InChIKey |
HOAGIWXMGSTBLK-UHFFFAOYSA-N |
Molecular Weight |
320.751 g/mol |
SMILES |
C(NC=1C(=CC=CC1)F)(C(=O)NCCC1=CC=C(C=C1)Cl)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909373 |