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N-PROPIONYL-D-NEURAMINIC-ACID

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N-PROPIONYL-D-NEURAMINIC-ACID
SpectraBase Compound ID CmAxkXZd6tu
InChI InChI=1S/C12H21NO9/c1-2-7(17)13-8-5(15)3-12(21,11(19)20)22-10(8)9(18)6(16)4-14/h5-6,8-10,14-16,18,21H,2-4H2,1H3,(H,13,17)(H,19,20)/p-1/t5-,6+,8+,9+,10+,12-/m0/s1
InChIKey QZBCMZXFDLYCRV-BVKYVCSXSA-M
Mol Weight 322.29 g/mol
Molecular Formula C12H20NO9
Exact Mass 322.113806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5TOfyeobsdb
Name N-PROPIONYL-D-NEURAMINIC-ACID
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20NO9
InChI InChI=1S/C12H21NO9/c1-2-7(17)13-8-5(15)3-12(21,11(19)20)22-10(8)9(18)6(16)4-14/h5-6,8-10,14-16,18,21H,2-4H2,1H3,(H,13,17)(H,19,20)/p-1/t5-,6+,8+,9+,10+,12-/m0/s1
InChIKey QZBCMZXFDLYCRV-BVKYVCSXSA-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 322.292 g/mol
Solvent D2O
Source File Reference UWSI24257