SpectraBase Spectrum ID |
GAWujDXJBxI |
Name |
(E)-.alpha.-(3,4-Methylenedioxybenzylidene)-.beta.-(3,4,5-trimethoxybenzyl)-gamma.-butyrolactone |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
398.136553041 u |
Formula |
C22H22O7 |
InChI |
InChI=1S/C22H22O7/c1-24-19-9-14(10-20(25-2)21(19)26-3)6-15-11-27-22(23)16(15)7-13-4-5-17-18(8-13)29-12-28-17/h4-5,7-10,15H,6,11-12H2,1-3H3/b16-7+ |
InChIKey |
YUMFRZDLFSZQIS-FRKPEAEDSA-N |
Molecular Weight |
398.411 g/mol |
SMILES |
C1(\C(C(CO1)CC1=CC(OC)=C(C(=C1)OC)OC)=C\C=1C=C2OCOC2=CC1)=O |