| SpectraBase Spectrum ID |
5XdMrSdYBfz |
| Name |
(2R,5S,6R)-2-tert-butyl-6-methyl-5-[4-(trifluoromethyl)benzyl]-1,3-dioxan-4-one |
| CAS Registry Number |
129287-77-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21F3O3 |
| InChI |
InChI=1S/C17H21F3O3/c1-10-13(14(21)23-15(22-10)16(2,3)4)9-11-5-7-12(8-6-11)17(18,19)20/h5-8,10,13,15H,9H2,1-4H3/t10-,13+,15-/m1/s1 |
| InChIKey |
MQWOMYYPAXEGBC-RIEGTJTDSA-N |
| Molecular Weight |
330.347 g/mol |
| SMILES |
C1(O[C@](C(C)(C)C)(O[C@@]([C@@]1(Cc1ccc(C(F)(F)F)cc1)[H])(C)[H])[H])=O |
| SPLASH |
splash10-0059-3792000000-e088ca9a8cc05b53307d |
| Source of Spectrum |
K-123-2426-42 |
| Synonyms |
(2R,5S,6R)-2-tert-butyl-6-methyl-5-[[4-(trifluoromethyl)phenyl]methyl]-1,3-dioxan-4-one |
| Wiley ID |
1327711 |
