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(2S,3R,5R,6S)-2-Acetoxy-6-benzyloxy-5-ethyl-5-hydroxy-3-methyloctanoic acid .delta.-lactone
SpectraBase Compound ID 9hHpYu0DeQK
InChI InChI=1S/C20H28O5/c1-5-17(23-13-16-10-8-7-9-11-16)20(6-2)12-14(3)18(19(22)25-20)24-15(4)21/h7-11,14,17-18H,5-6,12-13H2,1-4H3/t14-,17+,18+,20-/m1/s1
InChIKey VJKKRMRSFIAZAP-QBMUGXQSSA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6S1KeryaH73
Name (2S,3R,5R,6S)-2-Acetoxy-6-benzyloxy-5-ethyl-5-hydroxy-3-methyloctanoic acid .delta.-lactone
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Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-5-17(23-13-16-10-8-7-9-11-16)20(6-2)12-14(3)18(19(22)25-20)24-15(4)21/h7-11,14,17-18H,5-6,12-13H2,1-4H3/t14-,17+,18+,20-/m1/s1
InChIKey VJKKRMRSFIAZAP-QBMUGXQSSA-N
Molecular Weight 348.439 g/mol
SMILES C1(O[C@]([C@@](OCc2ccccc2)(CC)[H])(CC)C[C@]([C@@]1(OC(=O)C)[H])(C)[H])=O
SPLASH splash10-0006-9800000000-fd3e852cf7a6caef19dd
Source of Spectrum F-52-547-41
Synonyms (3S,4R,6R)-6-[(1S)-1-(benzyloxy)propyl]-6-ethyl-4-methyl-2-oxooxan-3-yl acetate
Wiley ID 794560