| SpectraBase Compound ID | IoXsmNtnSNW |
|---|---|
| InChI | InChI=1S/C17H25F9O3/c1-3-5-6-7-8-10-9-11(12(27)13(29-10)28-4-2)14(18,19)15(20,21)16(22,23)17(24,25)26/h10-13,27H,3-9H2,1-2H3/t10-,11+,12+,13-/m1/s1 |
| InChIKey | PPUVCSIAVBTGNE-MROQNXINSA-N |
| Mol Weight | 448.37 g/mol |
| Molecular Formula | C17H25F9O3 |
| Exact Mass | 448.165998 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DoSEIwFnwuV |
|---|---|
| Name | (2R*,3S*,4S*,6R*)-2-Ethoxy-6-hexyl-4-(perfluorobutyl)-tetrahydropyran-3-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H25F9O3 |
| InChI | InChI=1S/C17H25F9O3/c1-3-5-6-7-8-10-9-11(12(27)13(29-10)28-4-2)14(18,19)15(20,21)16(22,23)17(24,25)26/h10-13,27H,3-9H2,1-2H3/t10-,11+,12+,13-/m1/s1 |
| InChIKey | PPUVCSIAVBTGNE-MROQNXINSA-N |
| Molecular Weight | 448.370 g/mol |
| SMILES | O[C@]1([C@@](C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C[C@](O[C@]1(OCC)[H])(CCCCCC)[H])[H])[H] |
| SPLASH | splash10-014r-3797100000-a0033c802c133354b54b |
| Source of Spectrum | U1-2009-5829-(4S,6R)-8c/1 |
| Synonyms | (2R,3S,4S,6R)-2-ethoxy-6-hexyl-4-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-3-oxanol (2R,3S,4S,6R)-2-ethoxy-6-hexyl-4-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)oxan-3-ol (2R,3S,4S,6R)-2-ethoxy-6-hexyl-4-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butyl]oxan-3-ol |
| Wiley ID | 1697455 |