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Ibuprofen
SpectraBase Compound ID GmeBdweaJfU
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)
InChIKey HEFNNWSXXWATRW-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hI7m2RwXD5
Name Ibuprofen
Alternate Name(s) Advil Motrin (RS)-2-(4-(2-methylpropyl)phenyl)propanoic acid 2-(4-isobutylphenyl)propanoic acid
Copyright Copyright © 2020-2024 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)
InChIKey HEFNNWSXXWATRW-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES OC(C(c1ccc(CC(C)C)cc1)C)=O
SPLASH splash10-03xr-3900000000-cb814c9e682f7d235f85
Source of Spectrum SWG-33-3005-0
Wiley ID 1809984