| SpectraBase Spectrum ID |
3Cgj0gXxUpS |
| Name |
1-(3-Acetylphenyloxy)-2-nitro-5-fluorobenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
275.059385965 u |
| Formula |
C14H10FNO4 |
| InChI |
InChI=1S/C14H10FNO4/c1-9(17)10-3-2-4-12(7-10)20-14-8-11(15)5-6-13(14)16(18)19/h2-8H,1H3 |
| InChIKey |
JNFPNWFJFMALCA-UHFFFAOYSA-N |
| Molecular Weight |
275.235 g/mol |
| SMILES |
C1(=CC(=CC=C1N(=O)=O)F)OC1=CC(=CC=C1)C(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.836615 |
