| SpectraBase Spectrum ID |
HZ0jGALOX0X |
| Name |
3,2'-Dihydroxychalcone, bis(pentafluoropropionate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
532.036855047 u |
| Formula |
C21H10F10O5 |
| InChI |
InChI=1S/C21H10F10O5/c22-18(23,20(26,27)28)16(33)35-12-5-3-4-11(10-12)8-9-14(32)13-6-1-2-7-15(13)36-17(34)19(24,25)21(29,30)31/h1-10H/b9-8+ |
| InChIKey |
JYDJLQGHARIQAA-CMDGGOBGSA-N |
| Molecular Weight |
532.290 g/mol |
| SMILES |
C1(=CC=CC=C1OC(C(C(F)(F)F)(F)F)=O)C(\C=C\C1=CC=CC(=C1)OC(C(C(F)(F)F)(F)F)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909993 |
