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N-acetyl-D-mannosamine, 5TMS
SpectraBase Compound ID IB6r83d3bE4
InChI InChI=1S/C23H55NO6Si5.O/c1-18(25)24(31(2,3)4)20-22(29-34(11,12)13)21(28-33(8,9)10)19(17-26-32(5,6)7)27-23(20)30-35(14,15)16;/h19-23H,17H2,1-16H3;
InChIKey FJKYSGLHIYMVQL-UHFFFAOYSA-N
Mol Weight 598.1 g/mol
Molecular Formula C23H55NO7Si5
Exact Mass 597.282486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3xlcGL2aDA
Name N-acetyl-D-mannosamine, 5TMS
Comments Derivatization type: 5 TMS (mass: 599.298); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000078; Note: The molecular formula of the structure shown is C8H17NO7 - which differs from the formula reported for the mass spectrum (C23H57NO7Si5)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H57NO7Si5
InChI InChI=1S/C23H55NO6Si5.O/c1-18(25)24(31(2,3)4)20-22(29-34(11,12)13)21(28-33(8,9)10)19(17-26-32(5,6)7)27-23(20)30-35(14,15)16;/h19-23H,17H2,1-16H3;
InChIKey FJKYSGLHIYMVQL-UHFFFAOYSA-N
Molecular Weight 600.134 g/mol
SMILES O.CC(N(C1C(C(C(CO[Si](C)(C)C)OC1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)[Si](C)(C)C)=O
SPLASH splash10-0ktb-1931000000-7d5ccf5e8d30ad34559d
Source of Spectrum FM-2019-78-0
Synonyms N-Acetyl-beta-D-mannosamine, 5TMS beta-D-Mannopyranose, 2-(acetylamino)-2-deoxy-, 5TMS 7772-94-3, 5TMS N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide hydrate, 5TMS N-(trimethylsilyl)-N-(2,4,5-tris((trimethylsilyl)oxy)-6-(((trimethylsilyl)oxy)methyl)tetrahydro-2H-pyran-3-yl)acetamide hydrate
Wiley ID 1817774