| SpectraBase Spectrum ID |
2F7FeTp0YMF |
| Name |
Diethyl 4-(tridecafluoroheptyl)-3-iodomethylcyclopentane-1,1-dicarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H20F13IO4 |
| InChI |
InChI=1S/C19H20F13IO4/c1-3-36-11(34)13(12(35)37-4-2)5-9(7-33)10(6-13)15(23,24)17(27,28)19(31,32)18(29,30)16(25,26)14(21,22)8-20/h9-10H,3-8H2,1-2H3 |
| InChIKey |
GWAXBSSAJFJOBE-UHFFFAOYSA-N |
| Molecular Weight |
686.249 g/mol |
| SMILES |
C(C(C(C(F)(F)CF)(F)F)(F)F)(C(C(C1CC(C(=O)OCC)(C(=O)OCC)CC1CI)(F)F)(F)F)(F)F |
| SPLASH |
splash10-056r-0000090000-16b9da571142935769f4 |
| Source of Spectrum |
KC-0-1731-3 |
| Synonyms |
diethyl 3-(iodomethyl)-4-(1,1,2,2,3,3,4,4,5,5,6,6,7-tridecafluoroheptyl)-1,1-cyclopentanedicarboxylate |
| Wiley ID |
784056 |
