| SpectraBase Spectrum ID |
7ay83xY1pX5 |
| Name |
(2-Chloranyl-4-fluoranyl-5-methyl-phenyl)-phenyl-methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.040420804 u |
| Formula |
C14H10ClFO |
| InChI |
InChI=1S/C14H10ClFO/c1-9-7-11(12(15)8-13(9)16)14(17)10-5-3-2-4-6-10/h2-8H,1H3 |
| InChIKey |
YPPWTKYWKQMEIA-UHFFFAOYSA-N |
| Molecular Weight |
248.684 g/mol |
| SMILES |
C=1(C(=O)C2=CC=CC=C2)C(=CC(=C(C1)C)F)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931265 |
