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6,6-Dideuterioglucose - aldonitrile pentaacetate
SpectraBase Compound ID FKiMGyxUTLm
InChI InChI=1S/C16H21NO10/c1-8(18)23-7-14(25-10(3)20)16(27-12(5)22)15(26-11(4)21)13(6-17)24-9(2)19/h13-16H,7H2,1-5H3/i7D2
InChIKey INCBLRCTSZYSJE-RJSZUWSASA-N
Mol Weight 389.35 g/mol
Molecular Formula C16H192D2NO10
Exact Mass 389.129099 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gjRU4cHop6
Name 6,6-Dideuterioglucose - aldonitrile pentaacetate
Alternate Name(s) 6,6-Dideuterio-glucose - pentaacetyl aldonitrile 6,6-Dideuterio-glucose-pentaacetyl aldonitrile 6,6-Dideuterioglucose-aldonitrile pentaacetate
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Formula C16H19D2NO10
InChI InChI=1S/C16H21NO10/c1-8(18)23-7-14(25-10(3)20)16(27-12(5)22)15(26-11(4)21)13(6-17)24-9(2)19/h13-16H,7H2,1-5H3/i7D2
InChIKey INCBLRCTSZYSJE-RJSZUWSASA-N
Molecular Weight 389.353 g/mol
SMILES C(C(C(OC(=O)C)C(OC(=O)C)([2D])[2D])OC(=O)C)(C(C#N)OC(=O)C)OC(=O)C
SPLASH splash10-05mk-0920000000-c9a359cc5b7e6a8c7a5d
Source of Spectrum O-33-448-0
Wiley ID 763150