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2,4,5,6-Tetra-O-acetyl-3-O-methyl-D-gluconitrile
SpectraBase Compound ID H42d1hhn72G
InChI InChI=1S/C15H21NO9/c1-8(17)22-7-13(24-10(3)19)15(25-11(4)20)14(21-5)12(6-16)23-9(2)18/h12-15H,7H2,1-5H3
InChIKey RWCWXRUZHPANFS-UHFFFAOYSA-N
Mol Weight 359.33 g/mol
Molecular Formula C15H21NO9
Exact Mass 359.121631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bq3GZ1bAsA
Name 2,4,5,6-Tetra-O-acetyl-3-O-methyl-D-gluconitrile
CAS Registry Number 35439-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO9
InChI InChI=1S/C15H21NO9/c1-8(17)22-7-13(24-10(3)19)15(25-11(4)20)14(21-5)12(6-16)23-9(2)18/h12-15H,7H2,1-5H3
InChIKey RWCWXRUZHPANFS-UHFFFAOYSA-N
Molecular Weight 359.331 g/mol
SMILES C(C(C(C(C(C#N)OC(=O)C)OC)OC(=O)C)OC(=O)C)OC(=O)C
SPLASH splash10-00lf-6910000000-2ada260721040a75b822
Source of Spectrum W5-1989-36372-29164
Synonyms (2,3,5-triacetoxy-5-cyano-4-methoxy-pentyl) acetate (2,3,5-triacetyloxy-5-cyano-4-methoxy-pentyl) ethanoate (2,3,5-triacetyloxy-5-cyano-4-methoxypentyl) acetate Acetic acid (2,3,5-triacetoxy-5-cyano-4-methoxy-pentyl) ester Acetic acid (2,3,5-triacetyloxy-5-cyano-4-methoxypentyl) ester
Wiley ID 1347651