| SpectraBase Spectrum ID |
JPA54SeSFTk |
| Name |
1,3-Dioxan-4-one, 2-(1,1-dimethylethyl)-6-methyl-6-propyl-, (2R-trans)- |
| Alternate Name(s) |
(2R,6S)-2-tert-butyl-6-methyl-6-propyl-1,3-dioxan-4-one |
| CAS Registry Number |
107289-21-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H22O3 |
| InChI |
InChI=1S/C12H22O3/c1-6-7-12(5)8-9(13)14-10(15-12)11(2,3)4/h10H,6-8H2,1-5H3/t10-,12-/m0/s1 |
| InChIKey |
PTTLXKVEZFHUQG-JQWIXIFHSA-N |
| Molecular Weight |
214.305 g/mol |
| SMILES |
[C@]1(OC(C[C@@](O1)(CCC)C)=O)(C(C)(C)C)[H] |
| SPLASH |
splash10-0bti-9700000000-8082c94af9d0e32c2854 |
| Source of Spectrum |
C-110-4770-5 |
| Wiley ID |
1213611 |
