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p-isopropylbenzoic acid

View entire compound with spectra: 4 NMR, 4 FTIR, 2 UV-Vis, and 7 MS (GC)

p-isopropylbenzoic acid
SpectraBase Compound ID 6NRSAlxbcTI
InChI InChI=1S/C10H12O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7H,1-2H3,(H,11,12)
InChIKey CKMXAIVXVKGGFM-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6VjxiXNghl
Name Benzoic acid, 4-(1-methylethyl)-
Alternate Name(s) Benzoic acid, p-isopropyl- 4-(1-Methylethyl)benzoic acid 4-Isopropylbenzoic acid 4-Propan-2-ylbenzoic acid Cumic acid Cuminic acid p-Cumate p-Isopropylbenzoic acid AI3-17970 BRN 1907514 EINECS 208-642-5 NSC 1907
CAS Registry Number 536-66-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7H,1-2H3,(H,11,12)
InChIKey CKMXAIVXVKGGFM-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES OC(c1ccc(C(C)C)cc1)=O
SPLASH splash10-0002-3900000000-35bbc4cb37683d4228e1
Source of Spectrum AA-0-1061-2
Wiley ID 13728