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(2E,3S)-2-(4'-Hydroxy-3',5'-dimethoxybenzylidene)-3-(5"-methoxy-3",4"-methylenedioxybenzyl)-butyrolactone
SpectraBase Compound ID 80aO17kD6bw
InChI InChI=1S/C22H22O8/c1-25-16-6-13(7-17(26-2)20(16)23)5-15-14(10-28-22(15)24)4-12-8-18(27-3)21-19(9-12)29-11-30-21/h5-9,14,23H,4,10-11H2,1-3H3/b15-5+/t14-/m1/s1
InChIKey OOJSDEWTOLBIRE-YWKRCKIVSA-N
Mol Weight 414.41 g/mol
Molecular Formula C22H22O8
Exact Mass 414.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3IJs9ZUz6jc
Name (2E,3S)-2-(4'-Hydroxy-3',5'-dimethoxybenzylidene)-3-(5"-methoxy-3",4"-methylenedioxybenzyl)-butyrolactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O8
InChI InChI=1S/C22H22O8/c1-25-16-6-13(7-17(26-2)20(16)23)5-15-14(10-28-22(15)24)4-12-8-18(27-3)21-19(9-12)29-11-30-21/h5-9,14,23H,4,10-11H2,1-3H3/b15-5+/t14-/m1/s1
InChIKey OOJSDEWTOLBIRE-YWKRCKIVSA-N
Molecular Weight 414.410 g/mol
SMILES Oc1c(cc(\C=C\2C(OC[C@]2(Cc2cc3c(OCO3)c(c2)OC)[H])=O)cc1OC)OC
SPLASH splash10-014j-0960300000-08a0b3a9c257958ee557
Source of Spectrum G4-69-238-9
Synonyms (3E,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-2-oxolanone (3E,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]oxolan-2-one (3E,4S)-3-[(4-hydroxy-3,5-dimethoxy-phenyl)methylene]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]tetrahydrofuran-2-one (3E,4S)-3-[(3,5-dimethoxy-4-oxidanyl-phenyl)methylidene]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]oxolan-2-one
Wiley ID 1694609