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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) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H51EAO4V7uR
Name (S)-(+)-Ibuprofen
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 375160
CAS Registry Number 51146-56-6
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. 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
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (S)-(+)-2-(4-Isobutylphenyl)propionic acid (S)-(+)-4-Isobutyl-alpha-methylphenylacetic acid
Wiley ID SIAL_13CNMR_008073