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Ethyl rac-(1R,3aR,8bS)-3-Hydroxy-6,8-dimethoxy-1-(1-methylethyl)-3a,8b-dihydro-1H-cyclopenta[b]benzofuran-2-carboxylate
SpectraBase Compound ID LDnFUdZZjII
InChI InChI=1S/C19H24O6/c1-6-24-19(21)16-13(9(2)3)15-14-11(23-5)7-10(22-4)8-12(14)25-18(15)17(16)20/h7-9,13,15,18,20H,6H2,1-5H3/t13-,15+,18-/m1/s1
InChIKey IJECGMWUZJBIIT-QIIPPGSGSA-N
Mol Weight 348.4 g/mol
Molecular Formula C19H24O6
Exact Mass 348.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ii7fuYdf8F
Name Ethyl rac-(1R,3aR,8bS)-3-Hydroxy-6,8-dimethoxy-1-(1-methylethyl)-3a,8b-dihydro-1H-cyclopenta[b]benzofuran-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C19H24O6
InChI InChI=1S/C19H24O6/c1-6-24-19(21)16-13(9(2)3)15-14-11(23-5)7-10(22-4)8-12(14)25-18(15)17(16)20/h7-9,13,15,18,20H,6H2,1-5H3/t13-,15+,18-/m1/s1
InChIKey IJECGMWUZJBIIT-QIIPPGSGSA-N
Molecular Weight 348.395 g/mol
SMILES OC1=C([C@@]([C@]2(c3c(cc(cc3OC)OC)O[C@@]12[H])[H])(C(C)C)[H])C(=O)OCC
SPLASH splash10-004i-0904000000-daeeb1ec19f8c6ed8791
Source of Spectrum F-68-1221-6
Synonyms ethyl (1R,3aR,8bS)-3-hydroxy-1-isopropyl-6,8-dimethoxy-3a,8b-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate (1R,3aR,8bS)-3-hydroxy-6,8-dimethoxy-1-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b]benzofuran-2-carboxylic acid ethyl ester ethyl (1R,3aR,8bS)-3-hydroxy-6,8-dimethoxy-1-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate ethyl (1R,3aR,8bS)-3-hydroxy-1-isopropyl-6,8-dimethoxy-3a,8b-dihydro-1H-cyclopenta[b]benzofuran-2-carboxylate ethyl (1R,3aR,8bS)-6,8-dimethoxy-3-oxidanyl-1-propan-2-yl-3a,8b-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate
Wiley ID 1571817