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2-Hydroxymethyl-6-(3-nitro-phenoxy)-tetrahydro-pyran-3,4,5-triol
SpectraBase Compound ID APtl0R16c1R
InChI InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-2-6(4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
InChIKey VCCMGHVCRFMITI-RMPHRYRLSA-N
Mol Weight 301.25 g/mol
Molecular Formula C12H15NO8
Exact Mass 301.079766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIcFwu0VkvU
Name 2-Hydroxymethyl-6-(3-nitro-phenoxy)-tetrahydro-pyran-3,4,5-triol
Alternate Name(s) 3-Nitrophenyl .beta.-D-xylo-hexopyranoside
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO8
InChI InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-2-6(4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
InChIKey VCCMGHVCRFMITI-RMPHRYRLSA-N
Molecular Weight 301.251 g/mol
SMILES O[C@]1([C@@]([C@@](CO)(O[C@]([C@@]1(O)[H])(Oc1cc(N(=O)=O)ccc1)[H])[H])(O)[H])[H]
SPLASH splash10-004i-9400000000-058790ef7a36b8bd3068
Wiley ID 1453574