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4-Acetylbenzoic acid
SpectraBase Compound ID GwBSxEXN1QN
InChI InChI=1S/C9H8O3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3,(H,11,12)
InChIKey QBHDSQZASIBAAI-UHFFFAOYSA-N
Mol Weight 164.16 g/mol
Molecular Formula C9H8O3
Exact Mass 164.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gl5f7stXj5M
Name 4-Carboxy acetophenone
Alternate Name(s) 4-Acetylbenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O3
InChI InChI=1S/C9H8O3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3,(H,11,12)
InChIKey QBHDSQZASIBAAI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cctc.201200590
Molecular Weight 164.160 g/mol
SMILES OC(c1ccc(cc1)C(=O)C)=O
SPLASH splash10-0002-1900000000-02632d696300f7b381dc
Source of Spectrum CCC-5-126/SM6-6_3
Wiley ID 1786966