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#-20-(R)-MOSHERESTER;MINOR-DIASTEREOMER;(1'R,2''R)-4-[1'-TERT.-BUTOXYCARBONYLAMINO-2'-(3'',3'',3''-TRIFLUORO-2''-METHOXY-2''-PHENYL-PROPIONYLOXY)-ETHYL]-2,6-D
SpectraBase Compound ID 82awzrn8IUx
InChI InChI=1S/C28H35F3N2O9/c1-15-19(22(34)38-6)21(20(16(2)32-15)23(35)39-7)18(33-25(37)42-26(3,4)5)14-41-24(36)27(40-8,28(29,30)31)17-12-10-9-11-13-17/h9-13,18,21,32H,14H2,1-8H3,(H,33,37)/t18-,27-/m1/s1
InChIKey ZZPHZXPEZPLPHQ-DNOBIOAJSA-N
Mol Weight 600.6 g/mol
Molecular Formula C28H35F3N2O9
Exact Mass 600.229465 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EnA1BKKFq68
Name #-20-(R)-MOSHERESTER;MINOR-DIASTEREOMER;(1'R,2''R)-4-[1'-TERT.-BUTOXYCARBONYLAMINO-2'-(3'',3'',3''-TRIFLUORO-2''-METHOXY-2''-PHENYL-PROPIONYLOXY)-ETHYL]-2,6-D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H35F3N2O9
InChI InChI=1S/C28H35F3N2O9/c1-15-19(22(34)38-6)21(20(16(2)32-15)23(35)39-7)18(33-25(37)42-26(3,4)5)14-41-24(36)27(40-8,28(29,30)31)17-12-10-9-11-13-17/h9-13,18,21,32H,14H2,1-8H3,(H,33,37)/t18-,27-/m1/s1
InChIKey ZZPHZXPEZPLPHQ-DNOBIOAJSA-N
Literature Reference Author A.DONDONI,A.MASSI,E.MINGHINI,S.SABBATINI,V.BERTOLASI
Literature Reference Citation J.ORG.CHEM.,68,6172(2003)
Literature Reference DOI 10.1021/jo0342830
Solvent DMSO-D6
Source File Reference UWVN20793