| SpectraBase Spectrum ID |
5Wcumes0IrD |
| Name |
2S,6R-5-Benzylidene-2-(t-butyl)-6-(trifluoromethyl)-1,3-dioxan-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H17F3O3 |
| InChI |
InChI=1S/C16H17F3O3/c1-15(2,3)14-21-12(16(17,18)19)11(13(20)22-14)9-10-7-5-4-6-8-10/h4-9,12,14H,1-3H3/b11-9-/t12-,14+/m1/s1 |
| InChIKey |
DOKGXAXTCAPIRG-KRFXKNSESA-N |
| Molecular Weight |
314.304 g/mol |
| SMILES |
C1(\C([C@@](O[C@@](O1)(C(C)(C)C)[H])(C(F)(F)F)[H])=C/c1ccccc1)=O |
| SPLASH |
splash10-0a4i-5690000000-f3ef70c860127c77a0c6 |
| Source of Spectrum |
K-127-573-9 |
| Synonyms |
(2S,5Z,6R)-5-benzylidene-2-tert-butyl-6-(trifluoromethyl)-1,3-dioxan-4-one |
| Wiley ID |
1314873 |
