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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3E4PxdiYW33
Name 4-ACETYLBENZOIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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 Author A.DIJKSMAN,A.MARINO-GONZALEZ,A.M.I.PAYERAS,I.W.C.E.ARENDS,R. A.SHELDON
Literature Reference Citation J.AM.CHEM.SOC.,123,6826(2001)
Literature Reference DOI 10.1021/ja0103804
Molecular Weight 164.161 g/mol
Solvent DMSO
Source File Reference UWVN28094