| SpectraBase Spectrum ID |
9LJnd8s7c |
| Name |
(4R,5S,6S,6'S)-2-(2,2-Dimethyl[1,3]dioxan-4-yl)-5-hydroxy-2,4,6-trimethyldodec-10-yne-3-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H36O4 |
| InChI |
InChI=1S/C21H36O4/c1-8-9-10-11-12-15(2)18(22)16(3)19(23)20(4,5)17-13-14-24-21(6,7)25-17/h15-18,22H,10-14H2,1-7H3/t15-,16+,17-,18-/m0/s1 |
| InChIKey |
KZXWNPLHAKHORO-MHORFTMASA-N |
| Molecular Weight |
352.515 g/mol |
| SMILES |
O[C@]([C@](C(C([C@]1(OC(C)(C)OCC1)[H])(C)C)=O)(C)[H])([C@](CCCC#CC)(C)[H])[H] |
| SPLASH |
splash10-0apl-9500000000-2b8851bd79fffd666c2d |
| Source of Spectrum |
QE-7-5312-102 |
| Synonyms |
(4R,5S,6S)-2-[(4S)-2,2-dimethyl-1,3-dioxan-4-yl]-5-hydroxy-2,4,6-trimethyl-10-dodecyn-3-one |
| Wiley ID |
846244 |
![(4R,5S,6S,6'S)-2-(2,2-Dimethyl[1,3]dioxan-4-yl)-5-hydroxy-2,4,6-trimethyldodec-10-yne-3-one](/api/spectrum/9LJnd8s7c/structure.png?h=300&w=458 "(4R,5S,6S,6'S)-2-(2,2-Dimethyl[1,3]dioxan-4-yl)-5-hydroxy-2,4,6-trimethyldodec-10-yne-3-one")
