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Methyl trans-5,6-dihydro-6-(3,4,5-trimethoxyphenyl)-cyclobuta(f)-1,3-benzodioxole-5-carboxylate
SpectraBase Compound ID G89q823TIAc
InChI InChI=1S/C20H20O7/c1-22-15-5-10(6-16(23-2)19(15)24-3)17-11-7-13-14(27-9-26-13)8-12(11)18(17)20(21)25-4/h5-8,17-18H,9H2,1-4H3/t17-,18-/m0/s1
InChIKey BKWDBQKJAKPAAF-ROUUACIJSA-N
Mol Weight 372.37 g/mol
Molecular Formula C20H20O7
Exact Mass 372.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Izrrbu5kRn7
Name Methyl trans-5,6-dihydro-6-(3,4,5-trimethoxyphenyl)-cyclobuta(f)-1,3-benzodioxole-5-carboxylate
CAS Registry Number 94706-19-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O7
InChI InChI=1S/C20H20O7/c1-22-15-5-10(6-16(23-2)19(15)24-3)17-11-7-13-14(27-9-26-13)8-12(11)18(17)20(21)25-4/h5-8,17-18H,9H2,1-4H3/t17-,18-/m0/s1
InChIKey BKWDBQKJAKPAAF-ROUUACIJSA-N
Molecular Weight 372.373 g/mol
SMILES c12c(cc3c(c2)OCO3)[C@@]([C@]1(c1cc(OC)c(c(c1)OC)OC)[H])(C(=O)OC)[H]
SPLASH splash10-001r-9100000000-54c658b4c9aeb178de72
Source of Spectrum J-50-1104-84
Synonyms Methyl (5R,6S)-6-(3,4,5-trimethoxyphenyl)-5,6-dihydrocyclobuta[f][1,3]benzodioxole-5-carboxylate
Wiley ID 1355401