| SpectraBase Spectrum ID |
Cl97df0QD5W |
| Name |
1,3-Benzenediol, o-(4-trifluoromethylbenzoyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.050378636 u |
| Formula |
C14H9F3O3 |
| InChI |
InChI=1S/C14H9F3O3/c15-14(16,17)10-6-4-9(5-7-10)13(19)20-12-3-1-2-11(18)8-12/h1-8,18H |
| InChIKey |
RTTRKSCUXBKOSC-UHFFFAOYSA-N |
| Molecular Weight |
282.218 g/mol |
| SMILES |
C1(=CC(=CC=C1)O)OC(C1=CC=C(C(F)(F)F)C=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900615 |
