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p-butylbenzoic acid
SpectraBase Compound ID E5gvTCFeIKm
InChI InChI=1S/C11H14O2/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h5-8H,2-4H2,1H3,(H,12,13)
InChIKey JFKUBRAOUZEZSL-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGGXIaeVvkY
Name 4-Butylbenzoic acid
Alternate Name(s) Benzoic acid, 4-butyl- p-n-Butylbenzoic acid
CAS Registry Number 20651-71-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h5-8H,2-4H2,1H3,(H,12,13)
InChIKey JFKUBRAOUZEZSL-UHFFFAOYSA-N
Molecular Weight 178.231 g/mol
SMILES OC(c1ccc(cc1)CCCC)=O
SPLASH splash10-002u-7900000000-54b37e337ab662092a3c
Wiley ID 1494570