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2-Hydroxyibuprofen
SpectraBase Compound ID BOnkSJf4Duo
InChI InChI=1S/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)
InChIKey UJHKVYPPCJBOSG-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FjEu9Zmme
Name 2-[4-(2-hydroxy-2-methyl-propyl)phenyl]propanoic acid
Alternate Name(s) 2-[4-(2-hydroxy-2-methyl-propyl)phenyl]propionic acid 2-[4-(2-methyl-2-oxidanyl-propyl)phenyl]propanoic acid
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Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15)
InChIKey UJHKVYPPCJBOSG-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES OC(Cc1ccc(C(C(=O)O)C)cc1)(C)C
SPLASH splash10-07vl-6900000000-b11bc1a5a07a63696ff0
Source of Spectrum E2-50-747-0
Wiley ID 1555880