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METHYL-7,8,9-TRI-O-ACETYL-2,6-ANHYDRO-3,5-DIDEOXY-4-S-ETHYL-4-THIO-5-[(TRIFLUOROACETYL)-AMINO]-D-GLYCERO-D-TALO-NON-2-ENONATE
SpectraBase Compound ID 6CyThvlCKfh
InChI InChI=1S/C20H26F3NO10S/c1-6-35-14-7-12(18(28)30-5)34-17(15(14)24-19(29)20(21,22)23)16(33-11(4)27)13(32-10(3)26)8-31-9(2)25/h7,13-17H,6,8H2,1-5H3,(H,24,29)/t13-,14+,15+,16+,17+/m0/s1
InChIKey QEQUAHWRKVUICY-MZBWOGCUSA-N
Mol Weight 529.48 g/mol
Molecular Formula C20H26F3NO10S
Exact Mass 529.122952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1tn71TbAx4K
Name METHYL-7,8,9-TRI-O-ACETYL-2,6-ANHYDRO-3,5-DIDEOXY-4-S-ETHYL-4-THIO-5-[(TRIFLUOROACETYL)-AMINO]-D-GLYCERO-D-TALO-NON-2-ENONATE
Compound Number 20B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26F3NO10S
InChI InChI=1S/C20H26F3NO10S/c1-6-35-14-7-12(18(28)30-5)34-17(15(14)24-19(29)20(21,22)23)16(33-11(4)27)13(32-10(3)26)8-31-9(2)25/h7,13-17H,6,8H2,1-5H3,(H,24,29)/t13-,14+,15+,16+,17+/m0/s1
InChIKey QEQUAHWRKVUICY-MZBWOGCUSA-N
Literature Reference Author P.ALLEVI,P.ROTA,I.S.AGNOLIN,A.GREGORIO,M.ANASTASIA
Literature Reference Citation EUR.J.ORG.CHEM.,2013,4065(2013)
Literature Reference DOI 10.1002/ejoc.201300154
Molecular Weight 529.482 g/mol
Solvent CDCl3
Source File Reference UWBT18435