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2,3,4,5-Tetra-O-acetyl-6-O-methyl-D-gluconitrile
SpectraBase Compound ID 46NRGIDLD3o
InChI InChI=1S/C15H21NO9/c1-8(17)22-12(6-16)14(24-10(3)19)15(25-11(4)20)13(7-21-5)23-9(2)18/h12-15H,7H2,1-5H3
InChIKey DTVHZSXBTMLILO-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 Azdw8s4X1EW
Name 2,3,4,5-Tetra-O-acetyl-6-O-methyl-D-gluconitrile
CAS Registry Number 35439-76-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO9
InChI InChI=1S/C15H21NO9/c1-8(17)22-12(6-16)14(24-10(3)19)15(25-11(4)20)13(7-21-5)23-9(2)18/h12-15H,7H2,1-5H3
InChIKey DTVHZSXBTMLILO-UHFFFAOYSA-N
Molecular Weight 359.331 g/mol
SMILES C(C(C(C(COC)OC(=O)C)OC(C)=O)OC(=O)C)(OC(C)=O)C#N
SPLASH splash10-0002-5910000000-7db04c3160445962fa1b
Source of Spectrum W5-1989-36374-29162
Synonyms (3,4,5-triacetyloxy-5-cyano-1-methoxy-pentan-2-yl) ethanoate (3,4,5-triacetyloxy-5-cyano-1-methoxypentan-2-yl) acetate Acetic acid (3,4,5-triacetyloxy-5-cyano-1-methoxypentan-2-yl) ester [2,3,4-triacetoxy-4-cyano-1-(methoxymethyl)butyl] acetate
Wiley ID 1347652