SpectraBase Compound ID | 4mzd1AfvPzj |
---|---|
InChI | InChI=1S/C15H18F12O2/c1-2-3-4-5-6-7-9(28)29-8-11(18,19)13(22,23)15(26,27)14(24,25)12(20,21)10(16)17/h10H,2-8H2,1H3 |
InChIKey | ZBQGYLOCTOSSHS-UHFFFAOYSA-N |
Mol Weight | 458.29 g/mol |
Molecular Formula | C15H18F12O2 |
Exact Mass | 458.111518 g/mol |
SpectraBase Spectrum ID | 8KOSBATlXVy |
---|---|
Name | Octanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl ester |
CAS Registry Number | 18770-62-2 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C15H18F12O2 |
InChI | InChI=1S/C15H18F12O2/c1-2-3-4-5-6-7-9(28)29-8-11(18,19)13(22,23)15(26,27)14(24,25)12(20,21)10(16)17/h10H,2-8H2,1H3 |
InChIKey | ZBQGYLOCTOSSHS-UHFFFAOYSA-N |
Molecular Weight | 458.288 g/mol |
SMILES | C(CCCCCCC)(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
SPLASH | splash10-00r6-9103000000-0d64f53592addba5f38d |
Source of Spectrum | JX-2015-6-1115 |
Synonyms | 1,1,7-Trihydroperfluoroheptyl octanoate 2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptyl octanoate 2,2,3,3,4,4,5,5,6,6,7,7-dodecakis(fluoranyl)heptyl octanoate Caprylic acid 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl ester Octanoic acid 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl ester |
Wiley ID | 1727969 |