| SpectraBase Spectrum ID |
4MRjMkTvJTg |
| Name |
(1'S,2R,5S,6R)-5-(1'-Acetoxy-2'-cyclohexylmethyl)-2-(t-butyl)-6-methyl-1,3-dioxan-4-one |
| Alternate Name(s) |
(1S)-2-{[(2R,4R,5S)-2-tert-butyl-4-methyl-6-oxo-1,3-dioxan-5-yl]methyl}cyclohexyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H30O5 |
| InChI |
InChI=1S/C18H30O5/c1-11-14(16(20)23-17(21-11)18(3,4)5)10-13-8-6-7-9-15(13)22-12(2)19/h11,13-15,17H,6-10H2,1-5H3/t11-,13?,14+,15+,17-/m1/s1 |
| InChIKey |
XYRJFSAMYSMRGM-AXRNGSNBSA-N |
| Molecular Weight |
326.433 g/mol |
| SMILES |
C1([C@@](CC2[C@@](OC(=O)C)(CCCC2)[H])([C@@](C)(O[C@](O1)(C(C)(C)C)[H])[H])[H])=O |
| SPLASH |
splash10-0ilc-6931000000-e87f0924884d58fadb68 |
| Source of Spectrum |
H-76-469-3 |
| Wiley ID |
1324794 |
