| SpectraBase Compound ID | 4S7NBBhkord |
|---|---|
| InChI | InChI=1S/C12H15F9O3/c1-3-23-8-7(22)6(4-5(2)24-8)9(13,14)10(15,16)11(17,18)12(19,20)21/h5-8,22H,3-4H2,1-2H3/t5-,6+,7+,8+/m0/s1 |
| InChIKey | VVJHMWUWTXYMOT-LXGUWJNJSA-N |
| Mol Weight | 378.23 g/mol |
| Molecular Formula | C12H15F9O3 |
| Exact Mass | 378.087748 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5CiHHxVXwFx |
|---|---|
| Name | (2R*,3R*,4R*,6S*)-2-Ethoxy-6-methyl-4-(perfluorobutyl)-tetrahydropyran-3-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15F9O3 |
| InChI | InChI=1S/C12H15F9O3/c1-3-23-8-7(22)6(4-5(2)24-8)9(13,14)10(15,16)11(17,18)12(19,20)21/h5-8,22H,3-4H2,1-2H3/t5-,6+,7+,8+/m0/s1 |
| InChIKey | VVJHMWUWTXYMOT-LXGUWJNJSA-N |
| Molecular Weight | 378.235 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])(C)[H])[H])[H] |
| SPLASH | splash10-004l-0009000000-edfbf1c34f5b7b18f8b0 |
| Source of Spectrum | U1-2009-5828-(3R,6S)-8b/I |
| Synonyms | (2R,3R,4R,6S)-2-ethoxy-6-methyl-4-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-3-oxanol (2R,3R,4R,6S)-2-ethoxy-6-methyl-4-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)oxan-3-ol (2R,3R,4R,6S)-2-ethoxy-6-methyl-4-[1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butyl]oxan-3-ol |
| Wiley ID | 1697457 |