| SpectraBase Spectrum ID |
F2klPz6Ofzr |
| Name |
2-Fluoro-4'-hydroxybenzophenone, heptafluorobutyrate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
412.034569419 u |
| Formula |
C17H8F8O3 |
| InChI |
InChI=1S/C17H8F8O3/c18-12-4-2-1-3-11(12)13(26)9-5-7-10(8-6-9)28-14(27)15(19,20)16(21,22)17(23,24)25/h1-8H |
| InChIKey |
YTMWAAICHQIDKL-UHFFFAOYSA-N |
| Molecular Weight |
412.235 g/mol |
| SMILES |
C1(F)=C(C=CC=C1)C(=O)C1=CC=C(C=C1)OC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969469 |
