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(3S*,4S*)-3-Hydroxy-3-(3,4-methylenedioxybenzyl)-4-[.alpha.(S*)-.alpha.-methoxy-3,4-dimethoxybenzyl]-.gamma.-butyrolactone
SpectraBase Compound ID 3Jo9ePwXVTZ
InChI InChI=1S/C22H24O8/c1-25-15-7-5-14(9-17(15)26-2)20(27-3)21-22(24,11-19(23)30-21)10-13-4-6-16-18(8-13)29-12-28-16/h4-9,20-21,24H,10-12H2,1-3H3/t20-,21-,22-/m0/s1
InChIKey HTOBYQTYVDBZOL-FKBYEOEOSA-N
Mol Weight 416.43 g/mol
Molecular Formula C22H24O8
Exact Mass 416.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TCMa199BNd
Name (3S*,4S*)-3-Hydroxy-3-(3,4-methylenedioxybenzyl)-4-[.alpha.(S*)-.alpha.-methoxy-3,4-dimethoxybenzyl]-.gamma.-butyrolactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O8
InChI InChI=1S/C22H24O8/c1-25-15-7-5-14(9-17(15)26-2)20(27-3)21-22(24,11-19(23)30-21)10-13-4-6-16-18(8-13)29-12-28-16/h4-9,20-21,24H,10-12H2,1-3H3/t20-,21-,22-/m0/s1
InChIKey HTOBYQTYVDBZOL-FKBYEOEOSA-N
Molecular Weight 416.426 g/mol
SMILES O[C@@]1([C@@](OC(C1)=O)([C@](c1cc(OC)c(cc1)OC)(OC)[H])[H])Cc1cc2c(OCO2)cc1
SPLASH splash10-00m0-0900200000-647f4a5d48e19a203995
Source of Spectrum PS-0-2751-3
Wiley ID 786844