SpectraBase Spectrum ID |
5SCXkZqX3H5 |
Name |
4-Nitro-3-trifluoromethylbenzophenone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.045627608 u |
Formula |
C14H8F3NO3 |
InChI |
InChI=1S/C14H8F3NO3/c15-14(16,17)11-8-10(6-7-12(11)18(20)21)13(19)9-4-2-1-3-5-9/h1-8H |
InChIKey |
UNLUVZPUEHAJGG-UHFFFAOYSA-N |
Molecular Weight |
295.217 g/mol |
SMILES |
C(C=1C=C(C(=CC1)N(=O)=O)C(F)(F)F)(=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.861007 |