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TRANS-2-(3,5-DIMETHOXY-4-HYDROXYBENZYL)-3-(3,4-METHYLENEDIOXYBENZOYL)-BUTANOLIDE
SpectraBase Compound ID Blsu1nli1xR
InChI InChI=1S/C21H20O8/c1-25-17-6-11(7-18(26-2)20(17)23)5-13-14(9-27-21(13)24)19(22)12-3-4-15-16(8-12)29-10-28-15/h3-4,6-8,13-14,23H,5,9-10H2,1-2H3/t13-,14+/m1/s1
InChIKey YHLFTYONSQUWET-KGLIPLIRSA-N
Mol Weight 400.38 g/mol
Molecular Formula C21H20O8
Exact Mass 400.115818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58WP2qTqAn9
Name (3R,4R)-3-(4-hydroxy-3,5-dimethoxy-benzyl)-4-piperonyloyl-tetrahydrofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O8
InChI InChI=1S/C21H20O8/c1-25-17-6-11(7-18(26-2)20(17)23)5-13-14(9-27-21(13)24)19(22)12-3-4-15-16(8-12)29-10-28-15/h3-4,6-8,13-14,23H,5,9-10H2,1-2H3/t13-,14+/m1/s1
InChIKey YHLFTYONSQUWET-KGLIPLIRSA-N
Molecular Weight 400.383 g/mol
SMILES Oc1c(cc(C[C@@]2([C@@](C(c3cc4OCOc4cc3)=O)(COC2=O)[H])[H])cc1OC)OC
SPLASH splash10-0udj-0823900000-99a185b21c6d91db632d
Source of Spectrum H1-43-2455-18
Synonyms (3R,4R)-4-(1,3-benzodioxol-5-ylcarbonyl)-3-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]oxolan-2-one (3R,4R)-4-(1,3-benzodioxole-5-carbonyl)-3-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]tetrahydrofuran-2-one (3R,4R)-4-(1,3-benzodioxole-5-carbonyl)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-2-one (3R,4R)-4-[1,3-benzodioxol-5-yl(oxo)methyl]-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-2-oxolanone
Wiley ID 758146