| SpectraBase Spectrum ID |
6OUtvX24dj0 |
| Name |
Perfluorocinnamic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
273.986476411 u |
| Formula |
C9HF7O2 |
| InChI |
InChI=1S/C9HF7O2/c10-2-1(4(12)8(16)9(17)18)3(11)6(14)7(15)5(2)13/h(H,17,18)/b8-4+ |
| InChIKey |
SUMCXJKPHIGXTH-XBXARRHUSA-N |
| Molecular Weight |
274.094 g/mol |
| SMILES |
C1(=C(C(=C(C(=C1F)F)F)\C(=C\(F)C(O)=O)F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928286 |
