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N-ACETYLNEURAMINIC-ACID*3-(PROPIONAMIDO)-PHENYLBORONIC-ACID;MINOR-COMPLEX
SpectraBase Compound ID GARREZxdE1L
InChI InChI=1S/C20H27BN2O10/c1-3-15(26)23-12-6-4-5-11(7-12)21-31-9-14(33-21)17(27)18-16(22-10(2)24)13(25)8-20(30,32-18)19(28)29/h4-7,13-14,16-18,25,27,30H,3,8-9H2,1-2H3,(H,22,24)(H,23,26)(H,28,29)/t13-,14-,16+,17+,18+,20-/m0/s1
InChIKey DYFRSZFYHVZBPG-DGOPZAEOSA-N
Mol Weight 466.3 g/mol
Molecular Formula C20H27BN2O10
Exact Mass 466.175875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7wxT2ghTWZH
Name N-ACETYLNEURAMINIC-ACID*3-(PROPIONAMIDO)-PHENYLBORONIC-ACID;MINOR-COMPLEX
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27BN2O10
InChI InChI=1S/C20H27BN2O10/c1-3-15(26)23-12-6-4-5-11(7-12)21-31-9-14(33-21)17(27)18-16(22-10(2)24)13(25)8-20(30,32-18)19(28)29/h4-7,13-14,16-18,25,27,30H,3,8-9H2,1-2H3,(H,22,24)(H,23,26)(H,28,29)/t13-,14-,16+,17+,18+,20-/m0/s1
InChIKey DYFRSZFYHVZBPG-DGOPZAEOSA-N
Literature Reference Author H.OTSUKA,E.UCHIMURA,H.KOSHINO,T.OKANO,K.KATAOKA
Literature Reference Citation J.AM.CHEM.SOC.,125,3493(2003)
Literature Reference DOI 10.1021/ja021303r
Molecular Weight 466.252 g/mol
Sample ID 30241
Solvent DMSO-D6