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1,2:3,4-DI-O-ISOPROPYLIDENE-6-DEOXY-6-[3-CHLORO-4-(5-TRIFLUOROMETHYL-2(1H)-PYRIDONE-1-YL)-ANILINO]-ALPHA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID 7J0CSVeczCH
InChI InChI=1S/C24H26ClF3N2O6/c1-22(2)33-18-16(32-21-20(19(18)34-22)35-23(3,4)36-21)10-29-13-6-7-15(14(25)9-13)30-11-12(24(26,27)28)5-8-17(30)31/h5-9,11,16,18-21,29H,10H2,1-4H3/t16-,18+,19+,20-,21-/m1/s1
InChIKey BIEFABJSMPZHAI-OBJCFNGXSA-N
Mol Weight 530.93 g/mol
Molecular Formula C24H26ClF3N2O6
Exact Mass 530.143149 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fl3VkdOXd5
Name 1,2:3,4-DI-O-ISOPROPYLIDENE-6-DEOXY-6-[3-CHLORO-4-(5-TRIFLUOROMETHYL-2(1H)-PYRIDONE-1-YL)-ANILINO]-ALPHA-D-GALACTOPYRANOSIDE
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26ClF3N2O6
InChI InChI=1S/C24H26ClF3N2O6/c1-22(2)33-18-16(32-21-20(19(18)34-22)35-23(3,4)36-21)10-29-13-6-7-15(14(25)9-13)30-11-12(24(26,27)28)5-8-17(30)31/h5-9,11,16,18-21,29H,10H2,1-4H3/t16-,18+,19+,20-,21-/m1/s1
InChIKey BIEFABJSMPZHAI-OBJCFNGXSA-N
Literature Reference Author Q.LOU,X.MENG,Z.LAO,L.XUAN,J.BAI,Q.HOU,G.HU,R.LUO,L.TAO,Z.LI
Literature Reference Citation MOLECULES,17,884(2012)
Literature Reference DOI 10.3390/molecules17010884
Molecular Weight 530.928 g/mol
Sample ID 73032
Solvent CDCl3