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2-[N-[(TERT.-BUTYLOXY)-CARBONYL]-AMINO]-4-FLUORO-4-PENTENOIC-ACID;MAJOR-ROTAMER+MINOR-ROTAMER
SpectraBase Compound ID I3JESud4Xfh
InChI InChI=1S/2C10H16FNO4/c2*1-6(11)5-7(8(13)14)12-9(15)16-10(2,3)4/h2*7H,1,5H2,2-4H3,(H,12,15)(H,13,14)/t2*7-/m00/s1
InChIKey VYNIYWDOBWCAPY-VGMFFHCQSA-N
Mol Weight 466.48 g/mol
Molecular Formula C20H32F2N2O8
Exact Mass 466.212672 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GfSkinDBGYT
Name 2-[N-[(TERT.-BUTYLOXY)-CARBONYL]-AMINO]-4-FLUORO-4-PENTENOIC-ACID;MAJOR-ROTAMER+MINOR-ROTAMER
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32F2N2O8
InChI InChI=1S/2C10H16FNO4/c2*1-6(11)5-7(8(13)14)12-9(15)16-10(2,3)4/h2*7H,1,5H2,2-4H3,(H,12,15)(H,13,14)/t2*7-/m00/s1
InChIKey VYNIYWDOBWCAPY-VGMFFHCQSA-N
Literature Reference Author D.M.SHENDAGE,R.FROEHLICH,G.HAUFE
Literature Reference Citation ORG.LETTERS,6,3675(2004)
Literature Reference DOI 10.1021/ol048771l
Solvent CDCl3
Source File Reference UWLU50868