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4'-Acetylbiphenyl-2-carboxylic acid

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

4'-Acetylbiphenyl-2-carboxylic acid
SpectraBase Compound ID DiAbsgjh9KG
InChI InChI=1S/C15H12O3/c1-10(16)11-6-8-12(9-7-11)13-4-2-3-5-14(13)15(17)18/h2-9H,1H3,(H,17,18)
InChIKey MCNDIBNNLZUPIH-UHFFFAOYSA-N
Mol Weight 240.26 g/mol
Molecular Formula C15H12O3
Exact Mass 240.078644 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CVxOrrpDY5o
Name 4'-Acetylbiphenyl-2-carboxylic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.078644243 u
Formula C15H12O3
InChI InChI=1S/C15H12O3/c1-10(16)11-6-8-12(9-7-11)13-4-2-3-5-14(13)15(17)18/h2-9H,1H3,(H,17,18)
InChIKey MCNDIBNNLZUPIH-UHFFFAOYSA-N
Molecular Weight 240.258 g/mol
SMILES C=1C=C(C(C=2C=CC(=CC2)C(C)=O)=CC1)C(O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.8371