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2-Deoxy-3,4,5,6-tetra-O-acetyl-D-arabinohexononitrile
SpectraBase Compound ID IaruvTmtJtb
InChI InChI=1S/C14H19NO8/c1-8(16)20-7-13(22-10(3)18)14(23-11(4)19)12(5-6-15)21-9(2)17/h12-14H,5,7H2,1-4H3/t12-,13-,14+/m1/s1
InChIKey AIZJFSFWFGCZAI-MCIONIFRSA-N
Mol Weight 329.31 g/mol
Molecular Formula C14H19NO8
Exact Mass 329.111067 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTOKF6F3sJ6
Name 2-Deoxy-3,4,5,6-tetra-O-acetyl-D-arabinohexononitrile
Alternate Name(s) (2R,3S,4R)-1,2,4-tris(acetyloxy)-5-cyanopentan-3-yl acetate Acetic acid (1S,2R)-2-acetoxy-3-cyano-1-((R)-1,2-diacetoxy-ethyl)-propyl ester Acetic acid[(2R,3S,4R)-2,3,4-triacetoxy-5-cyano-pentyl]ester Acetic acid[(2R,3S,4R)-2,3,4-triacetyloxy-5-cyanopentyl]ester [(2R,3S,4R)-2,3,4-triacetoxy-5-cyano-pentyl]acetate [(2R,3S,4R)-2,3,4-triacetyloxy-5-cyano-pentyl]ethanoate [(2R,3S,4R)-2,3,4-triacetyloxy-5-cyanopentyl]acetate Acetic acid [(2R,3S,4R)-2,3,4-triacetyloxy-5-cyanopentyl] ester [(2R,3S,4R)-2,3,4-triacetyloxy-5-cyanopentyl] acetate [(2R,3S,4R)-2,3,4-triacetoxy-5-cyano-pentyl] acetate [(2R,3S,4R)-2,3,4-triacetyloxy-5-cyano-pentyl] ethanoate
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Formula C14H19NO8
InChI InChI=1S/C14H19NO8/c1-8(16)20-7-13(22-10(3)18)14(23-11(4)19)12(5-6-15)21-9(2)17/h12-14H,5,7H2,1-4H3/t12-,13-,14+/m1/s1
InChIKey AIZJFSFWFGCZAI-MCIONIFRSA-N
Molecular Weight 329.305 g/mol
SMILES [C@]([C@](OC(=O)C)(COC(=O)C)[H])([C@](OC(=O)C)(CC#N)[H])(OC(=O)C)[H]
SPLASH splash10-0006-9810000000-cd1b89eada631e19b337
Source of Spectrum AT-41-5405-4
Wiley ID 854825