| SpectraBase Spectrum ID |
6x7YdFCImUF |
| Name |
2-(3,4-di(Pentafluoropropionyl)oxyphenyl)-2,3-dihydro-5,7-di(pentafluoropropionyl)oxy-4H-1-benzopyran-4-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
871.979809708 u |
| Formula |
C27H8F20O10 |
| InChI |
InChI=1S/C27H8F20O10/c28-20(29,24(36,37)38)16(49)53-8-4-13-15(14(5-8)57-19(52)23(34,35)27(45,46)47)9(48)6-11(54-13)7-1-2-10(55-17(50)21(30,31)25(39,40)41)12(3-7)56-18(51)22(32,33)26(42,43)44/h1-5,11H,6H2 |
| InChIKey |
FDCXUYZBMAUPJK-UHFFFAOYSA-N |
| Molecular Weight |
872.319 g/mol |
| SMILES |
C1=C(C(OC(C(C(F)(F)F)(F)F)=O)=CC=C1C1CC(C2=C(C=C(C=C2OC(C(C(F)(F)F)(F)F)=O)OC(C(C(F)(F)F)(F)F)=O)O1)=O)OC(C(C(F)(F)F)(F)F)=O |
