John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BPgBxO3dbIN SpectraBase Spectrum ID=11tKgGQ8cI0

(accessed ).
FLTPWVDOPKIZKR-KQJDLNKQSA-N
SpectraBase Compound ID BPgBxO3dbIN
InChI InChI=1S/C28H37NO2/c1-21-15-17-25(28(2,3)24-13-9-6-10-14-24)23(19-21)20-29-26(27(30)31-4)18-16-22-11-7-5-8-12-22/h5-14,20-21,23,25-26H,15-19H2,1-4H3/b29-20+/t21-,23+,25-,26-/m1/s1
InChIKey FLTPWVDOPKIZKR-KQJDLNKQSA-N
Mol Weight 419.6 g/mol
Molecular Formula C28H37NO2
Exact Mass 419.28243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11tKgGQ8cI0
Name FLTPWVDOPKIZKR-KQJDLNKQSA-N
Compound Number 3-(R=PHENETHYL)
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H37NO2
InChI InChI=1S/C28H37NO2/c1-21-15-17-25(28(2,3)24-13-9-6-10-14-24)23(19-21)20-29-26(27(30)31-4)18-16-22-11-7-5-8-12-22/h5-14,20-21,23,25-26H,15-19H2,1-4H3/b29-20+/t21-,23+,25-,26-/m1/s1
InChIKey FLTPWVDOPKIZKR-KQJDLNKQSA-N
Literature Reference Author L.MEYER,J.M.POIRIER,P.DUHAMEL,L.DUHAMEL
Literature Reference Citation J.ORG.CHEM.,63,8094(1998)
Literature Reference DOI 10.1021/jo981710e
Molecular Weight 419.607 g/mol
Sample ID 26823
Solvent CDCl3
SpectraBase Batch ID KgegrQGvKri