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[(2S,3R,4S,5R,6R)-6-allyloxy-4,5-dihydroxy-2-methyl-tetrahydropyran-3-yl] acetate
SpectraBase Compound ID 5b1xB3sX3sy
InChI InChI=1S/C11H18O6/c1-4-5-15-11-9(14)8(13)10(6(2)16-11)17-7(3)12/h4,6,8-11,13-14H,1,5H2,2-3H3/t6-,8-,9+,10-,11+/m0/s1
InChIKey DDKKJXYSFJJRNF-JWKFFPHGSA-N
Mol Weight 246.26 g/mol
Molecular Formula C11H18O6
Exact Mass 246.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDnU6MN6a1C
Name [(2S,3R,4S,5R,6R)-6-allyloxy-4,5-dihydroxy-2-methyl-tetrahydropyran-3-yl] acetate
Appearance White solid
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Exact Mass 246.110338294 u
Formula C11H18O6
InChI InChI=1S/C11H18O6/c1-4-5-15-11-9(14)8(13)10(6(2)16-11)17-7(3)12/h4,6,8-11,13-14H,1,5H2,2-3H3/t6-,8-,9+,10-,11+/m0/s1
InChIKey DDKKJXYSFJJRNF-JWKFFPHGSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201501491
Molecular Weight 246.259 g/mol
Optical Rotation [a]D20 = -94.1 (c = 1.46, CH2Cl2)
Quality 237
Reported Formula C11H18O6
SMILES O[C@@]1([C@]([C@@](O[C@]([C@@]1(O)[H])(OCC=C)[H])(C)[H])(OC(C)=O)[H])[H]
SPLASH splash10-0006-9400000000-3a19386b2798e96dc0df
Source of Spectrum QE-21-SM53-53 (DOI: 10.1002/chem.201501491)
Wiley ID 1906758