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2(S*)-[.alpha.(S*)-Acetoxy-3,4-dimethoxybenzyl]-3(S*)-[.alpha.(R*)-3,4-(methylenedioxy)benzyl]butyrolactone
SpectraBase Compound ID KSzx7Yb6am1
InChI InChI=1S/C23H24O9/c1-12(24)32-22(14-5-6-16(27-2)18(9-14)28-3)20-15(10-29-23(20)26)21(25)13-4-7-17-19(8-13)31-11-30-17/h4-9,15,20-22,25H,10-11H2,1-3H3/t15-,20-,21+,22-/m1/s1
InChIKey FLJCXKNTYAJTAN-ZHHJKBAOSA-N
Mol Weight 444.44 g/mol
Molecular Formula C23H24O9
Exact Mass 444.142032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNDWTc7luqh
Name 2(S*)-[.alpha.(S*)-Acetoxy-3,4-dimethoxybenzyl]-3(S*)-[.alpha.(R*)-3,4-(methylenedioxy)benzyl]butyrolactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H24O9
InChI InChI=1S/C23H24O9/c1-12(24)32-22(14-5-6-16(27-2)18(9-14)28-3)20-15(10-29-23(20)26)21(25)13-4-7-17-19(8-13)31-11-30-17/h4-9,15,20-22,25H,10-11H2,1-3H3/t15-,20-,21+,22-/m1/s1
InChIKey FLJCXKNTYAJTAN-ZHHJKBAOSA-N
Molecular Weight 444.436 g/mol
SMILES O[C@]([C@]1([C@]([C@@](c2cc(OC)c(cc2)OC)(OC(=O)C)[H])(C(OC1)=O)[H])[H])(c1cc2OCOc2cc1)[H]
SPLASH splash10-0udi-0901000000-86cfb4cb57819d8f6173
Source of Spectrum J-60-1152-12
Wiley ID 1385947