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Carboxyibuprofen
SpectraBase Compound ID CTt9IemhUzf
InChI InChI=1S/C13H16O4/c1-8(12(14)15)7-10-3-5-11(6-4-10)9(2)13(16)17/h3-6,8-9H,7H2,1-2H3,(H,14,15)(H,16,17)
InChIKey DIVLBIVDYADZPL-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 722wQexTNvW
Name 2-(4-(2-Carboxylpropyl)phenyl)oropionic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-8(12(14)15)7-10-3-5-11(6-4-10)9(2)13(16)17/h3-6,8-9H,7H2,1-2H3,(H,14,15)(H,16,17)
InChIKey DIVLBIVDYADZPL-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 236.267 g/mol
SMILES OC(C(Cc1ccc(C(C(O)=O)C)cc1)C)=O
SPLASH splash10-029y-9000000000-322478a5a83427ecf4cf
Source of Spectrum SRH-2022-11087-0
Wiley ID 1832693