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N-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-[(5-S)-5-METHYL-4-OXO-2,2-BIS-(TRIFLUOROMETHYL)-1,3-DIOXOLAN-5-YL]-ACETAMIDE

View entire compound with spectra: 2 NMR

N-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-[(5-S)-5-METHYL-4-OXO-2,2-BIS-(TRIFLUOROMETHYL)-1,3-DIOXOLAN-5-YL]-ACETAMIDE
SpectraBase Compound ID 7obZisQRWr5
InChI InChI=1S/C22H25F6NO13/c1-8(30)36-7-12-14(37-9(2)31)15(38-10(3)32)16(39-11(4)33)17(40-12)29-13(34)6-19(5)18(35)41-20(42-19,21(23,24)25)22(26,27)28/h12,14-17H,6-7H2,1-5H3,(H,29,34)/t12-,14-,15+,16-,17-,19-/m0/s1
InChIKey VZFGQPAALFESKB-WTYHRGFESA-N
Mol Weight 625.43 g/mol
Molecular Formula C22H25F6NO13
Exact Mass 625.123009 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FlHNNgDgCZf
Name N-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-[(5-S)-5-METHYL-4-OXO-2,2-BIS-(TRIFLUOROMETHYL)-1,3-DIOXOLAN-5-YL]-ACETAMIDE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25F6NO13
InChI InChI=1S/C22H25F6NO13/c1-8(30)36-7-12-14(37-9(2)31)15(38-10(3)32)16(39-11(4)33)17(40-12)29-13(34)6-19(5)18(35)41-20(42-19,21(23,24)25)22(26,27)28/h12,14-17H,6-7H2,1-5H3,(H,29,34)/t12-,14-,15+,16-,17-,19-/m0/s1
InChIKey VZFGQPAALFESKB-WTYHRGFESA-N
Literature Reference Author C.BOETTCHER,J.SPENGLER,K.BURGER
Literature Reference Citation MH.CHEM.,135,1225(2004)
Literature Reference DOI 10.1007/s00706-004-0187-5
Molecular Weight 625.430 g/mol
Solvent CDCl3
Source File Reference UWMZ11913