SpectraBase Spectrum ID |
DZHPrckj0eK |
Name |
Benzamide, N-(2-fluorophenyl)-3-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
229.090292172 u |
Formula |
C14H12FNO |
InChI |
InChI=1S/C14H12FNO/c1-10-5-4-6-11(9-10)14(17)16-13-8-3-2-7-12(13)15/h2-9H,1H3,(H,16,17) |
InChIKey |
QQHQWNFBMJFHKQ-UHFFFAOYSA-N |
Molecular Weight |
229.254 g/mol |
SMILES |
C1(=CC=CC(=C1)C(NC=1C(=CC=CC1)F)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947075 |