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(5S,5aS,8aS)-5-(3,4-dimethoxyphenyl)-8a-hydroxy-5,5a,6,9-tetrahydro-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one
SpectraBase Compound ID EdpzYUCM37S
InChI InChI=1S/C21H20O7/c1-24-15-4-3-11(5-16(15)25-2)19-13-7-18-17(27-10-28-18)6-12(13)8-21(23)14(19)9-26-20(21)22/h3-7,14,19,23H,8-10H2,1-2H3/t14-,19+,21+/m1/s1
InChIKey LYFPZCYPDXNOLI-RFVSGWPVSA-N
Mol Weight 384.38 g/mol
Molecular Formula C21H20O7
Exact Mass 384.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDcrq3VjOQn
Name (5S,5aS,8aS)-5-(3,4-dimethoxyphenyl)-8a-hydroxy-5,5a,6,9-tetrahydro-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one
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Formula C21H20O7
InChI InChI=1S/C21H20O7/c1-24-15-4-3-11(5-16(15)25-2)19-13-7-18-17(27-10-28-18)6-12(13)8-21(23)14(19)9-26-20(21)22/h3-7,14,19,23H,8-10H2,1-2H3/t14-,19+,21+/m1/s1
InChIKey LYFPZCYPDXNOLI-RFVSGWPVSA-N
Molecular Weight 384.384 g/mol
SMILES O[C@]12[C@@]([C@@](c3cc(OC)c(cc3)OC)(c3c(C1)cc1c(OCO1)c3)[H])(COC2=O)[H]
SPLASH splash10-001r-0019000000-e7d397da78b35843308d
Source of Spectrum PS-0-2751-2
Synonyms (5S,5aS,8aS)-5-(3,4-dimethoxyphenyl)-8a-hydroxy-5,5a,6,9-tetrahydroisobenzofuro[6,5-f][1,3]benzodioxol-8-one (5S,5aS,8aS)-5-(3,4-dimethoxyphenyl)-8a-oxidanyl-5,5a,6,9-tetrahydro-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one
Wiley ID 786834