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N-DIFLUOROACETYL-D-NEURAMINIC-ACID
SpectraBase Compound ID 4LzO679BuIc
InChI InChI=1S/C11H17F2NO9/c12-8(13)9(19)14-5-3(16)1-11(22,10(20)21)23-7(5)6(18)4(17)2-15/h3-8,15-18,22H,1-2H2,(H,14,19)(H,20,21)/p-1/t3-,4+,5+,6+,7+,11-/m0/s1
InChIKey RCHZBVQCKDNPMN-CIBNABSHSA-M
Mol Weight 344.24 g/mol
Molecular Formula C11H16F2NO9
Exact Mass 344.079312 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BoPsXF4W6Iv
Name N-DIFLUOROACETYL-D-NEURAMINIC-ACID
Compound Number 6F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H16F2NO9
InChI InChI=1S/C11H17F2NO9/c12-8(13)9(19)14-5-3(16)1-11(22,10(20)21)23-7(5)6(18)4(17)2-15/h3-8,15-18,22H,1-2H2,(H,14,19)(H,20,21)/p-1/t3-,4+,5+,6+,7+,11-/m0/s1
InChIKey RCHZBVQCKDNPMN-CIBNABSHSA-M
Literature Reference Author A.J.HUMPHREY,C.FREMANN,P.CRITCHLEY,Y.MALYKH,R.SCHAUER,T.D.H. BUGG
Literature Reference Citation BIOORG.MED.CHEM.,10,3175(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00213-4
Molecular Weight 344.246 g/mol
Solvent D2O
Source File Reference UWSI24261