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(3R,4R)-3-(4-Hydroxy-3-methoxybenzoyl)-4-(4-hydroxy-3-methoxybenzyl)tetrahydrofuran
SpectraBase Compound ID 7zwlOZWTCmW
InChI InChI=1S/C20H22O6/c1-24-18-8-12(3-5-16(18)21)7-14-10-26-11-15(14)20(23)13-4-6-17(22)19(9-13)25-2/h3-6,8-9,14-15,21-22H,7,10-11H2,1-2H3/t14-,15-/m0/s1
InChIKey VVVNSDLMCOLBCY-GJZGRUSLSA-N
Mol Weight 358.39 g/mol
Molecular Formula C20H22O6
Exact Mass 358.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6w36dyQ2NFr
Name (3R,4R)-3-(4-Hydroxy-3-methoxybenzoyl)-4-(4-hydroxy-3-methoxybenzyl)tetrahydrofuran
Appearance Colorless oil
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Formula C20H22O6
InChI InChI=1S/C20H22O6/c1-24-18-8-12(3-5-16(18)21)7-14-10-26-11-15(14)20(23)13-4-6-17(22)19(9-13)25-2/h3-6,8-9,14-15,21-22H,7,10-11H2,1-2H3/t14-,15-/m0/s1
InChIKey VVVNSDLMCOLBCY-GJZGRUSLSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np050089s
Molecular Weight 358.390 g/mol
Optical Rotation [aD20 = +5 (c = 0.4, CHCl3)
Reported Formula C20H22O6
SMILES Oc1c(cc(C([C@@]2([C@@](Cc3cc(c(cc3)O)OC)(COC2)[H])[H])=O)cc1)OC
SPLASH splash10-114i-0903000000-79b164167d5174ee3991
Source of Spectrum G4-68-1467-6
Wiley ID 1879472