| SpectraBase Spectrum ID |
A4X0E81A40U |
| Name |
3A,8-Dihydroxy-3,5A,9-trimethyl-4,5,6,7,8,9B-hexahydro-3H-benzo[G][1]benzofuran-2-one, ac |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.162373868 u |
| Formula |
C17H24O5 |
| InChI |
InChI=1S/C17H24O5/c1-9-12(21-11(3)18)5-6-16(4)7-8-17(20)10(2)15(19)22-14(17)13(9)16/h10,12,14,20H,5-8H2,1-4H3 |
| InChIKey |
BSDNINXXOARKLP-UHFFFAOYSA-N |
| SMILES |
CC(=O)OC1C(C)=C2C(C)(CC1)CCC1(O)C2OC(C1C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.874484 |
![3A,8-Dihydroxy-3,5A,9-trimethyl-4,5,6,7,8,9B-hexahydro-3H-benzo[G][1]benzofuran-2-one, ac](/api/spectrum/A4X0E81A40U/structure.png?h=300&w=458 "3A,8-Dihydroxy-3,5A,9-trimethyl-4,5,6,7,8,9B-hexahydro-3H-benzo[G][1]benzofuran-2-one, ac")
