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KCSOJJYHZCJSFB-UHFFFAOYSA-N
SpectraBase Compound ID JjyAvckYjkO
InChI InChI=1S/C18H23F3N4O7S/c1-2-13-32-17(27)24(11-5-9-22-16(26)18(19,20)21)12-6-10-23-33(30,31)15-8-4-3-7-14(15)25(28)29/h2-4,7-8,23H,1,5-6,9-13H2,(H,22,26)
InChIKey KCSOJJYHZCJSFB-UHFFFAOYSA-N
Mol Weight 496.46 g/mol
Molecular Formula C18H23F3N4O7S
Exact Mass 496.123955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KYR2a9LvPMF
Name KCSOJJYHZCJSFB-UHFFFAOYSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H23F3N4O7S
InChI InChI=1S/C18H23F3N4O7S/c1-2-13-32-17(27)24(11-5-9-22-16(26)18(19,20)21)12-6-10-23-33(30,31)15-8-4-3-7-14(15)25(28)29/h2-4,7-8,23H,1,5-6,9-13H2,(H,22,26)
InChIKey KCSOJJYHZCJSFB-UHFFFAOYSA-N
Literature Reference Author T.OPATZ,R.M.J.LISKAMP
Literature Reference Citation ORG.LETTERS,3,3499(2001)
Literature Reference DOI 10.1021/ol0101741
Molecular Weight 496.458 g/mol
Solvent CDCl3
Source File Reference UWLU35788