| SpectraBase Spectrum ID |
BlT1wtWsjxV |
| Name |
2,6-Bis[3,4-(methylenedioxy)phenyl]-3,7-dioxobicyclo[3.3.0]octane |
| Alternate Name(s) |
(2R,6R)-2,6-Bis[3,4-(methylenedioxy)phenyl]-3,7-dioxobicyclo[3.3.0]octane
1,4-di(1,3-benzodioxol-5-yl)tetrahydro-2,5(1H,3H)-pentalenedione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H18O6 |
| InChI |
InChI=1S/C22H18O6/c23-15-8-14-13(21(15)11-1-3-17-19(5-11)27-9-25-17)7-16(24)22(14)12-2-4-18-20(6-12)28-10-26-18/h1-6,13-14,21-22H,7-10H2/t13?,14?,21-,22-/m0/s1 |
| InChIKey |
LBXWATKMKCTVFL-ITQCSFDJSA-N |
| Molecular Weight |
378.380 g/mol |
| SMILES |
C12C([C@](c3cc4OCOc4cc3)(C(C2)=O)[H])CC([C@]1(c1cc2OCOc2cc1)[H])=O |
| SPLASH |
splash10-004i-0009000000-6e27c217b9af561f9025 |
| Source of Spectrum |
J-60-3061-21 |
| Wiley ID |
1358833 |
![2,6-Bis[3,4-(methylenedioxy)phenyl]-3,7-dioxobicyclo[3.3.0]octane](/api/spectrum/BlT1wtWsjxV/structure.png?h=300&w=458 "2,6-Bis[3,4-(methylenedioxy)phenyl]-3,7-dioxobicyclo[3.3.0]octane")
