![Propanoic acid, pentafluoro-, 1-[3-methoxy-4-(2,2,3,3,3-pentafluoro-1-oxopropoxy)phenyl]-1,2-ethanediyl ester](/api/spectrum/KiDMKeNbcj8/structure.png?h=300&w=458 "Propanoic acid, pentafluoro-, 1-[3-methoxy-4-(2,2,3,3,3-pentafluoro-1-oxopropoxy)phenyl]-1,2-ethanediyl ester")
| SpectraBase Compound ID | K8TS9prjvF1 |
|---|---|
| InChI | InChI=1S/C18H9F15O7/c1-37-8-4-6(2-3-7(8)39-11(35)14(21,22)17(28,29)30)9(40-12(36)15(23,24)18(31,32)33)5-38-10(34)13(19,20)16(25,26)27/h2-4,9H,5H2,1H3 |
| InChIKey | IBBPTMDXVHITSG-UHFFFAOYSA-N |
| Mol Weight | 622.24 g/mol |
| Molecular Formula | C18H9F15O7 |
| Exact Mass | 622.010875 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KiDMKeNbcj8 |
|---|---|
| Name | Propanoic acid, pentafluoro-, 1-[3-methoxy-4-(2,2,3,3,3-pentafluoro-1-oxopropoxy)phenyl]-1,2-ethanediyl ester |
| CAS Registry Number | 56728-12-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H9F15O7 |
| InChI | InChI=1S/C18H9F15O7/c1-37-8-4-6(2-3-7(8)39-11(35)14(21,22)17(28,29)30)9(40-12(36)15(23,24)18(31,32)33)5-38-10(34)13(19,20)16(25,26)27/h2-4,9H,5H2,1H3 |
| InChIKey | IBBPTMDXVHITSG-UHFFFAOYSA-N |
| Molecular Weight | 622.239 g/mol |
| SMILES | C(C(OC(c1cc(OC)c(OC(C(C(F)(F)F)(F)F)=O)cc1)COC(C(C(F)(F)F)(F)F)=O)=O)(C(F)(F)F)(F)F |
| SPLASH | splash10-06dj-0532903000-422d8a10fc99270488f1 |
| Source of Spectrum | KO-14-678-1 |
| Synonyms | 4-Hydroxy-3-methoxyphenethylene glycol tripfp 4-(1,2-Bis[(2,2,3,3,3-pentafluoropropanoyl)oxy]ethyl)-2-methoxyphenyl 2,2,3,3,3-pentafluoropropanoate 4-Hydroxy-3-methoxyphenyl-1,2-ethanediol,tris(pentafluoropropanoate)(ester) Pentafluoropropionyl derivative of 3-methoxy-4-hydroxyphenylglycol 2,2,3,3,3-pentafluoropropanoic acid [2-[3-methoxy-4-(2,2,3,3,3-pentafluoro-1-oxopropoxy)phenyl]-2-(2,2,3,3,3-pentafluoro-1-oxopropoxy)ethyl] ester [2-[3-methoxy-4-(2,2,3,3,3-pentafluoropropanoyloxy)phenyl]-2-(2,2,3,3,3-pentafluoropropanoyloxy)ethyl] 2,2,3,3,3-pentafluoropropanoate [2-[3-methoxy-4-[2,2,3,3,3-pentakis(fluoranyl)propanoyloxy]phenyl]-2-[2,2,3,3,3-pentakis(fluoranyl)propanoyloxy]ethyl] 2,2,3,3,3-pentakis(fluoranyl)propanoate |
| Wiley ID | 1411626 |