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3-O-(2'-Propynyl)-.beta.-D-fructopyranose
SpectraBase Compound ID 6NxQy7yR8F1
InChI InChI=1S/C9H14O6/c1-2-3-14-8-7(12)6(11)4-15-9(8,13)5-10/h1,6-8,10-13H,3-5H2/t6-,7-,8+,9-/m1/s1
InChIKey IHCOVUPOWRINLH-LURQLKTLSA-N
Mol Weight 218.2 g/mol
Molecular Formula C9H14O6
Exact Mass 218.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1NA4bPgTOS
Name 3-O-(2'-Propynyl)-.beta.-D-fructopyranose
Alternate Name(s) (2R,3S,4R,5R)-2-(hydroxymethyl)-3-(prop-2-yn-1-yloxy)tetrahydro-2H-pyran-2,4,5-triol (2R,3S,4R,5R)-2-(hydroxymethyl)-3-prop-2-ynoxyoxane-2,4,5-triol (2R,3S,4R,5R)-2-(hydroxymethyl)-3-prop-2-ynoxy-tetrahydropyran-2,4,5-triol (2R,3S,4R,5R)-2-(hydroxymethyl)-3-prop-2-ynoxy-oxane-2,4,5-triol
Comments Less than 3 mono-isotopic peaks
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Formula C9H14O6
InChI InChI=1S/C9H14O6/c1-2-3-14-8-7(12)6(11)4-15-9(8,13)5-10/h1,6-8,10-13H,3-5H2/t6-,7-,8+,9-/m1/s1
InChIKey IHCOVUPOWRINLH-LURQLKTLSA-N
Molecular Weight 218.205 g/mol
SMILES OC[C@@]1([C@]([C@@]([C@@](CO1)(O)[H])(O)[H])(OCC#C)[H])O
SPLASH splash10-0ik9-0980000000-f06e28e66a6388b783ec
Source of Spectrum F5-3-2285-3c
Wiley ID 1732365