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(S)-(+)-Ibuprofen

View entire compound with spectra: 3 NMR, 3 FTIR, 1 Raman, and 1 MS (GC)

(S)-(+)-Ibuprofen
SpectraBase Compound ID 7nLNxiMKEqZ
InChI InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1
InChIKey HEFNNWSXXWATRW-JTQLQIEISA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JD0fJL1aeud
Name (+/-)-IBUPROFEN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1
InChIKey HEFNNWSXXWATRW-JTQLQIEISA-N
Literature Reference Author A.L.ROMERO,L.H.B.BAPTISTELLA,F.COELHO,P.M.IMAMURA
Literature Reference Citation QUIM.NOVA,35,1680(2012)
Literature Reference DOI 10.1590/s0100-40422012000800031
Molecular Weight 206.285 g/mol
Solvent CDCl3
Source File Reference UWIR12530