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(3R*,4S*)-3-Hydroxy-3-[3,4-(methylenedioxy)benzyl]-4-(3,4-dimethoxybenzyl]-.gamma.-butyrolactone
SpectraBase Compound ID 41Qkt1Uivzt
InChI InChI=1S/C21H22O7/c1-24-15-5-3-13(7-17(15)25-2)9-19-21(23,11-20(22)28-19)10-14-4-6-16-18(8-14)27-12-26-16/h3-8,19,23H,9-12H2,1-2H3/t19-,21+/m0/s1
InChIKey BGHDMLPITMXAEA-PZJWPPBQSA-N
Mol Weight 386.4 g/mol
Molecular Formula C21H22O7
Exact Mass 386.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdxzPrQ6MRd
Name (3R*,4S*)-3-Hydroxy-3-[3,4-(methylenedioxy)benzyl]-4-(3,4-dimethoxybenzyl]-.gamma.-butyrolactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O7
InChI InChI=1S/C21H22O7/c1-24-15-5-3-13(7-17(15)25-2)9-19-21(23,11-20(22)28-19)10-14-4-6-16-18(8-14)27-12-26-16/h3-8,19,23H,9-12H2,1-2H3/t19-,21+/m0/s1
InChIKey BGHDMLPITMXAEA-PZJWPPBQSA-N
Molecular Weight 386.400 g/mol
SMILES O[C@@]1(CC(=O)O[C@]1(Cc1cc(OC)c(cc1)OC)[H])Cc1cc2OCOc2cc1
SPLASH splash10-000i-0901000000-5ab21c97e8c48f650863
Source of Spectrum J-61-6929-2
Synonyms (3R*,4S*)-3-Hydroxy-3-[3,4-(methylenedioxy)benzyl]-4-(3,4-dimethoxybenzyl)-.gamma.-butyrolactone (4R,5S)-4-(2H-1,3-benzodioxol-5-ylmethyl)-5-[(3,4-dimethoxyphenyl)methyl]-4-hydroxyoxolan-2-one
Wiley ID 1362612