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4-(2-Phenylethynyl)benzoic acid

View entire compound with spectra: 2 MS (GC)

4-(2-Phenylethynyl)benzoic acid
SpectraBase Compound ID 9BQM7XQrW71
InChI InChI=1S/C15H10O2/c16-15(17)14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-5,8-11H,(H,16,17)
InChIKey OGZUGPOTBGMCLE-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C15H10O2
Exact Mass 222.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzHnGHWeYFf
Name 4-(2-Phenylethynyl)benzoic acid
Alternate Name(s) 4-(Phenylethynyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10O2
InChI InChI=1S/C15H10O2/c16-15(17)14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-5,8-11H,(H,16,17)
InChIKey OGZUGPOTBGMCLE-UHFFFAOYSA-N
Molecular Weight 222.243 g/mol
SMILES OC(c1ccc(C#Cc2ccccc2)cc1)=O
SPLASH splash10-00di-0190000000-309d030d5806410334c9
Source of Spectrum SK-32-1943-3
Wiley ID 1548732