![Methyl (2E,6E)-7-ethyl-10-[(2,2,3,3,4,4,4-heptafluorobutanoyl)oxy]-11-methoxy-3,11-dimethyl-2,6-tridecadienoate](/api/spectrum/7Yl8DzTTS6N/structure.png?h=300&w=458 "Methyl (2E,6E)-7-ethyl-10-[(2,2,3,3,4,4,4-heptafluorobutanoyl)oxy]-11-methoxy-3,11-dimethyl-2,6-tridecadienoate")
| SpectraBase Compound ID | OR9MPKjkpy |
|---|---|
| InChI | InChI=1S/C23H33F7O5/c1-7-16(11-9-10-15(3)14-18(31)33-5)12-13-17(20(4,8-2)34-6)35-19(32)21(24,25)22(26,27)23(28,29)30/h11,14,17H,7-10,12-13H2,1-6H3/b15-14+,16-11+ |
| InChIKey | YCIPZPSOCUWVGB-CDMXPSGYSA-N |
| Mol Weight | 522.5 g/mol |
| Molecular Formula | C23H33F7O5 |
| Exact Mass | 522.221621 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7Yl8DzTTS6N |
|---|---|
| Name | Methyl (2E,6E)-7-ethyl-10-[(2,2,3,3,4,4,4-heptafluorobutanoyl)oxy]-11-methoxy-3,11-dimethyl-2,6-tridecadienoate |
| CAS Registry Number | 70028-64-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H33F7O5 |
| InChI | InChI=1S/C23H33F7O5/c1-7-16(11-9-10-15(3)14-18(31)33-5)12-13-17(20(4,8-2)34-6)35-19(32)21(24,25)22(26,27)23(28,29)30/h11,14,17H,7-10,12-13H2,1-6H3/b15-14+,16-11+ |
| InChIKey | YCIPZPSOCUWVGB-CDMXPSGYSA-N |
| Molecular Weight | 522.501 g/mol |
| SMILES | CC\C(CCC(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)C(C)(CC)OC)=C/CC\C(C)=C\C(=O)OC |
| SPLASH | splash10-000i-9600000000-96a5950fe7e2960ff28f |
| Source of Spectrum | W5-1989-10104-1 |
| Synonyms | (2E,6E)-7-ethyl-10-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)-11-methoxy-3,11-dimethyltrideca-2,6-dienoic acid methyl ester (2E,6E)-7-ethyl-10-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)-11-methoxy-3,11-dimethyl-trideca-2,6-dienoic acid methyl ester Methyl (2E,6E)-7-ethyl-10-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)-11-methoxy-3,11-dimethyl-trideca-2,6-dienoate Methyl (2E,6E)-7-ethyl-10-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoyloxy]-11-methoxy-3,11-dimethyl-trideca-2,6-dienoate Methyl 7-ethyl-10-(heptafluorobutyryloxy)-11-methoxy-3,11-dimethyl-2,6-tridecadienoate |
| Wiley ID | 1402199 |