For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
METHYL-6-DEOXY-6-[3-CHLORO-4-(5-TRIFLUOROMETHYL-2(1H)-PYRIDONE-1-YL)-ANILINO]-ALPHA-D-MANNOPYRANOSIDE
SpectraBase Compound ID 7Bjpxxgu9Tk
InChI InChI=1S/2C19H20ClF3N2O6/c2*1-30-18-17(29)16(28)15(27)13(31-18)7-24-10-3-4-12(11(20)6-10)25-8-9(19(21,22)23)2-5-14(25)26/h2*2-6,8,13,15-18,24,27-29H,7H2,1H3/t2*13-,15-,16+,17+,18+/m11/s1
InChIKey PNYRTYKIKRWFKS-GWHFCVRHSA-N
Mol Weight 929.65 g/mol
Molecular Formula C38H40Cl2F6N4O12
Exact Mass 928.192397 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID vxVbFXv2UA
Name METHYL-6-DEOXY-6-[3-CHLORO-4-(5-TRIFLUOROMETHYL-2(1H)-PYRIDONE-1-YL)-ANILINO]-ALPHA-D-MANNOPYRANOSIDE
Compound Number 16B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H40Cl2F6N4O12
InChI InChI=1S/2C19H20ClF3N2O6/c2*1-30-18-17(29)16(28)15(27)13(31-18)7-24-10-3-4-12(11(20)6-10)25-8-9(19(21,22)23)2-5-14(25)26/h2*2-6,8,13,15-18,24,27-29H,7H2,1H3/t2*13-,15-,16+,17+,18+/m11/s1
InChIKey PNYRTYKIKRWFKS-GWHFCVRHSA-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 929.652 g/mol
Sample ID 73042
Solvent CD3OD