| SpectraBase Spectrum ID |
GtPUzytn7rw |
| Name |
1,2-Dihydro-11.beta.-hydroxy-.alpha.-santonin |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.136159120 u |
| Formula |
C15H20O4 |
| InChI |
InChI=1S/C15H20O4/c1-8-10(16)5-7-14(2)6-4-9-12(11(8)14)19-13(17)15(9,3)18/h9,12,18H,4-7H2,1-3H3/t9-,12+,14+,15-/m1/s1 |
| InChIKey |
PKSNDJUCHSGBKJ-WNPSNZDDSA-N |
| Molecular Weight |
264.321 g/mol |
| SMILES |
[C@]12(C3=C(C(=O)CC[C@]3(C)CC[C@]1([C@](O)(C)C(O2)=O)[H])C)[H] |
