SpectraBase Spectrum ID |
2FcPsiDCfst |
Name |
Diallyl 2,6-Bis[3,4-(methylenedioxy)phenyl]-3,7-dioxobicyclo[3.3.0]octane-2,6-dicarboxylate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H26O10 |
InChI |
InChI=1S/C30H26O10/c1-3-9-35-27(33)29(17-5-7-21-23(11-17)39-15-37-21)19-13-26(32)30(20(19)14-25(29)31,28(34)36-10-4-2)18-6-8-22-24(12-18)40-16-38-22/h3-8,11-12,19-20H,1-2,9-10,13-16H2/t19?,20?,29-,30-/m1/s1 |
InChIKey |
PDNCDHLDWWXXER-KXZOJGEJSA-N |
Molecular Weight |
546.528 g/mol |
SMILES |
[C@]1(C2C([C@@](c3cc4OCOc4cc3)(C(=O)OCC=C)C(C2)=O)CC1=O)(c1cc2OCOc2cc1)C(=O)OCC=C |
SPLASH |
splash10-0006-9000010000-df712557eb470b7b5cc1 |
Source of Spectrum |
J-60-3061-20 |
Synonyms |
(1S,4S)-1,4-Bis-benzo[1,3]dioxol-5-yl-2,5-dioxo-octahydro-pentalene-1,4-dicarboxylic acid diallyl ester
diallyl 1,4-di(1,3-benzodioxol-5-yl)-2,5-dioxooctahydro-1,4-pentalenedicarboxylate |
Wiley ID |
1405247 |