| SpectraBase Spectrum ID |
KAtnybh0lqo |
| Name |
Acetic acid, 1-acetoxy-10A,12A-dimethyl-5-oxo-hexadecahydro-6-oxabenzo[3,4]cyclohepta[1,2-E]inden-8-yl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
406.235538809 u |
| Formula |
C23H34O6 |
| InChI |
InChI=1S/C23H34O6/c1-13(24)27-15-7-9-23(4)18-8-10-22(3)17(5-6-19(22)28-14(2)25)16(18)12-21(26)29-20(23)11-15/h15-20H,5-12H2,1-4H3 |
| InChIKey |
ICFHFOMKTZRYEJ-UHFFFAOYSA-N |
| Molecular Weight |
406.519 g/mol |
| SMILES |
C1(=O)OC2CC(OC(C)=O)CCC2(C2C(C1)C1CCC(C1(C)CC2)OC(=O)C)C |
![Acetic acid, 1-acetoxy-10a,12a-dimethyl-5-oxo-hexadecahydro-6-oxabenzo[3,4]cyclohepta[1,2-E]inden-8-yl ester](/api/spectrum/KAtnybh0lqo/structure.png?h=300&w=458 "Acetic acid, 1-acetoxy-10a,12a-dimethyl-5-oxo-hexadecahydro-6-oxabenzo[3,4]cyclohepta[1,2-E]inden-8-yl ester")
