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Benzoic acid, 2-(1-methylethyl)-
SpectraBase Compound ID 2tIC79LiITD
InChI InChI=1S/C10H12O2/c1-7(2)8-5-3-4-6-9(8)10(11)12/h3-7H,1-2H3,(H,11,12)
InChIKey BANZVKGLDQDFDV-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 6AapaddBG5f
Name Benzoic acid, 2-(1-methylethyl)-
Alternate Name(s) 2-Isopropylbenzoic acid 2-Propan-2-ylbenzoic acid
CAS Registry Number 2438-04-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-7(2)8-5-3-4-6-9(8)10(11)12/h3-7H,1-2H3,(H,11,12)
InChIKey BANZVKGLDQDFDV-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES OC(c1ccccc1C(C)C)=O
SPLASH splash10-0faj-5900000000-6034ffeb22bc670221e7
Source of Spectrum O-10-6-1
Wiley ID 1160189