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(3R,4S,5R,6R)-6-(2-(4-Methoxybenzyloxy)ethyl)-4-hydroxy-3,5-dimethyl-tetrahydropyran-2-one
SpectraBase Compound ID 5N2OFC3LEyp
InChI InChI=1S/C17H24O5/c1-11-15(22-17(19)12(2)16(11)18)8-9-21-10-13-4-6-14(20-3)7-5-13/h4-7,11-12,15-16,18H,8-10H2,1-3H3/t11-,12+,15+,16-/m0/s1
InChIKey FKCJDMNXBYQHFG-OJDYBEQGSA-N
Mol Weight 308.37 g/mol
Molecular Formula C17H24O5
Exact Mass 308.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXU0UTjXJd
Name (3R,4S,5R,6R)-6-(2-(4-Methoxybenzyloxy)ethyl)-4-hydroxy-3,5-dimethyl-tetrahydropyran-2-one
Appearance Colorless oil
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Formula C17H24O5
InChI InChI=1S/C17H24O5/c1-11-15(22-17(19)12(2)16(11)18)8-9-21-10-13-4-6-14(20-3)7-5-13/h4-7,11-12,15-16,18H,8-10H2,1-3H3/t11-,12+,15+,16-/m0/s1
InChIKey FKCJDMNXBYQHFG-OJDYBEQGSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0006.607
Molecular Weight 308.374 g/mol
Optical Rotation [a]D = +66.6 (c = 1.05, CH2Cl2)
Reported Formula C17H45O5
SMILES O[C@]1([C@]([C@@](CCOCc2ccc(OC)cc2)(OC([C@@]1(C)[H])=O)[H])(C)[H])[H]
SPLASH splash10-00dr-2900000000-5c331c915e58ee0c36eb
Source of Spectrum ARK-2005-77-12
Thin-Layer Chromatography Rf = 0.21 (EtOAc/hexanes, 50%)
Wiley ID 1871047