For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E)-.alpha.-(3,4-Methylenedioxybenzylidene)-.beta.-(3,4,5-trimethoxybenzyl)-gamma.-butyrolactone
SpectraBase Compound ID FE8ukBmfTw9
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
Mol Weight 398.41 g/mol
Molecular Formula C22H22O7
Exact Mass 398.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

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