| SpectraBase Spectrum ID |
3ohAC38jz35 |
| Name |
[5-Acetyloxy-3-(hydroxymethyl)-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] 3-methylbutanoate, ac derivative |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
368.183503235 u |
| Formula |
C19H28O7 |
| InChI |
InChI=1S/C19H28O7/c1-10(2)7-16(22)26-19-17(11(3)4)15(25-13(6)21)8-14(18(19)23)9-24-12(5)20/h8,10-11,15,17,19H,7,9H2,1-6H3 |
| InChIKey |
RURSMOJQOMDNLH-UHFFFAOYSA-N |
| Molecular Weight |
368.426 g/mol |
| SMILES |
C(CC(C)C)(=O)OC1C(C(=CC(C1C(C)C)OC(=O)C)COC(=O)C)=O |
![[5-Acetyloxy-3-(hydroxymethyl)-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] 3-methylbutanoate, ac derivative](/api/spectrum/3ohAC38jz35/structure.png?h=300&w=458 "[5-Acetyloxy-3-(hydroxymethyl)-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] 3-methylbutanoate, ac derivative")
