| SpectraBase Spectrum ID |
GphbwYhsByC |
| Name |
(4-Fluorophenyl)(3-nitrophenyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.048821282 u |
| Formula |
C13H8FNO3 |
| InChI |
InChI=1S/C13H8FNO3/c14-11-6-4-9(5-7-11)13(16)10-2-1-3-12(8-10)15(17)18/h1-8H |
| InChIKey |
AOHVHRTYAQSPFQ-UHFFFAOYSA-N |
| Molecular Weight |
245.209 g/mol |
| SMILES |
C1=CC(C(=O)C2=CC=CC(=C2)N(=O)=O)=CC=C1F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910294 |
