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5-[(1S)-2-(ALPHA-D-GLUCOPYRANOSYLOXY)-1-HYDROXY-ETHYL]-1-PHENYL-PYRAZOLE-3-CARBOXALDEHYDE
SpectraBase Compound ID 1laYKoVUAet
InChI InChI=1S/C18H22N2O8/c21-7-10-6-12(20(19-10)11-4-2-1-3-5-11)13(23)9-27-18-17(26)16(25)15(24)14(8-22)28-18/h1-7,13-18,22-26H,8-9H2/t13-,14-,15-,16+,17-,18+/m0/s1
InChIKey OYOWESZCFOQNAN-ZCVDQKGDSA-N
Mol Weight 394.38 g/mol
Molecular Formula C18H22N2O8
Exact Mass 394.137616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C88W0MyRY0a
Name 5-[(1S)-2-(ALPHA-D-GLUCOPYRANOSYLOXY)-1-HYDROXY-ETHYL]-1-PHENYL-PYRAZOLE-3-CARBOXALDEHYDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22N2O8
InChI InChI=1S/C18H22N2O8/c21-7-10-6-12(20(19-10)11-4-2-1-3-5-11)13(23)9-27-18-17(26)16(25)15(24)14(8-22)28-18/h1-7,13-18,22-26H,8-9H2/t13-,14-,15-,16+,17-,18+/m0/s1
InChIKey OYOWESZCFOQNAN-ZCVDQKGDSA-N
Literature Reference Author N.OIKAWA,C.MUELLER,M.KUNZ,F.W.LICHTENTHALER
Literature Reference Citation CARBOHYDR.RES.,309,269(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00137-2
Molecular Weight 394.381 g/mol
Solvent ME2SO-D6