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Ibuprofen-M (3-HO- ME
SpectraBase Compound ID BNberg8Vtan
InChI InChI=1S/C14H20O3/c1-10(13(15)17-4)12-7-5-11(6-8-12)9-14(2,3)16/h5-8,10,16H,9H2,1-4H3
InChIKey GVQBZZMJMBIALH-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDOhv6bGMbc
Name 2-[4-(2-hydroxy-2-methyl-propyl)phenyl]propionic acid methyl ester
Alternate Name(s) 2-[4-(2-hydroxy-2-methylpropyl)phenyl]propanoic acid methyl ester Methyl 2-[4-(2-hydroxy-2-methyl-propyl)phenyl]propanoate Methyl 2-[4-(2-methyl-2-oxidanyl-propyl)phenyl]propanoate
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Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-10(13(15)17-4)12-7-5-11(6-8-12)9-14(2,3)16/h5-8,10,16H,9H2,1-4H3
InChIKey GVQBZZMJMBIALH-UHFFFAOYSA-N
Molecular Weight 236.311 g/mol
SMILES OC(Cc1ccc(C(C(=O)OC)C)cc1)(C)C
SPLASH splash10-014i-3900000000-565a87c54a65dd907ad7
Source of Spectrum JC-99-549-7
Wiley ID 1238324