![Propyl 3-(2-[(2,2,3,3,4,4,4-heptafluorobutanoyl)amino]cyclohexyl)propanoate](/api/spectrum/11soicwP1FV/structure.png?h=300&w=458 "Propyl 3-(2-[(2,2,3,3,4,4,4-heptafluorobutanoyl)amino]cyclohexyl)propanoate")
| SpectraBase Compound ID | 8vviSBvOfEZ |
|---|---|
| InChI | InChI=1S/C16H22F7NO3/c1-2-9-27-12(25)8-7-10-5-3-4-6-11(10)24-13(26)14(17,18)15(19,20)16(21,22)23/h10-11H,2-9H2,1H3,(H,24,26) |
| InChIKey | KWRSORZPZNODKL-UHFFFAOYSA-N |
| Mol Weight | 409.34 g/mol |
| Molecular Formula | C16H22F7NO3 |
| Exact Mass | 409.148791 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 11soicwP1FV |
|---|---|
| Name | Propyl 3-(2-[(2,2,3,3,4,4,4-heptafluorobutanoyl)amino]cyclohexyl)propanoate |
| CAS Registry Number | 77369-52-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H22F7NO3 |
| InChI | InChI=1S/C16H22F7NO3/c1-2-9-27-12(25)8-7-10-5-3-4-6-11(10)24-13(26)14(17,18)15(19,20)16(21,22)23/h10-11H,2-9H2,1H3,(H,24,26) |
| InChIKey | KWRSORZPZNODKL-UHFFFAOYSA-N |
| Molecular Weight | 409.345 g/mol |
| SMILES | N(C1C(CCCC1)CCC(OCCC)=O)C(=O)C(F)(F)C(F)(F)C(F)(F)F |
| SPLASH | splash10-000i-8921000000-a22b96f05ebd24c4a710 |
| Source of Spectrum | W5-1989-6830-1 |
| Synonyms | 3-[2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)cyclohexyl]propionic acid propyl ester 3-[2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]cyclohexyl]propanoic acid propyl ester Cyclohexanepropanoic acid, 2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]-, propyl ester, trans- Propyl 3-[2-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoylamino]cyclohexyl]propanoate |
| Wiley ID | 1373256 |