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

View entire compound with spectra: 2 NMR

N-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-[(4-RS)-5-OXO-2,2-BIS-(TRIFLUOROMETHYL)-1,3-OXATHIOLAN-4-YL]-ACETAMIDE
SpectraBase Compound ID 2yf0ckHxd1V
InChI InChI=1S/2C21H23F6NO12S/c2*1-7(29)35-6-11-14(36-8(2)30)15(37-9(3)31)16(38-10(4)32)17(39-11)28-13(33)5-12-18(34)40-19(41-12,20(22,23)24)21(25,26)27/h2*11-12,14-17H,5-6H2,1-4H3,(H,28,33)/t2*11-,12+,14-,15+,16-,17-/m11/s1
InChIKey FVEOBISBUDWKIA-OIVRKVEDSA-N
Mol Weight 1254.92 g/mol
Molecular Formula C42H46F12N2O24S2
Exact Mass 1254.169031 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GAnD069yikn
Name N-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-2-[(4-RS)-5-OXO-2,2-BIS-(TRIFLUOROMETHYL)-1,3-OXATHIOLAN-4-YL]-ACETAMIDE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H46F12N2O24S2
InChI InChI=1S/2C21H23F6NO12S/c2*1-7(29)35-6-11-14(36-8(2)30)15(37-9(3)31)16(38-10(4)32)17(39-11)28-13(33)5-12-18(34)40-19(41-12,20(22,23)24)21(25,26)27/h2*11-12,14-17H,5-6H2,1-4H3,(H,28,33)/t2*11-,12+,14-,15+,16-,17-/m11/s1
InChIKey FVEOBISBUDWKIA-OIVRKVEDSA-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 1254.927 g/mol
Solvent CDCl3
Source File Reference UWMZ11941