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4-Phenylbicyclo[2.2.2]octane-1-carboxylic acid

View entire compound with spectra: 2 MS (GC)

4-Phenylbicyclo[2.2.2]octane-1-carboxylic acid
SpectraBase Compound ID AcYyESV939
InChI InChI=1S/C15H18O2/c16-13(17)15-9-6-14(7-10-15,8-11-15)12-4-2-1-3-5-12/h1-5H,6-11H2,(H,16,17)
InChIKey SQHNZAVLCQLHKE-UHFFFAOYSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ik0GFbdG9cL
Name 4-Phenylbicyclo[2.2.2]octane-1-carboxylic acid
Alternate Name(s) 1-Phenyl-4-bicyclo[2.2.2]octanecarboxylic acid 1-Phenylbicyclo[2.2.2]octane-4-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2
InChI InChI=1S/C15H18O2/c16-13(17)15-9-6-14(7-10-15,8-11-15)12-4-2-1-3-5-12/h1-5H,6-11H2,(H,16,17)
InChIKey SQHNZAVLCQLHKE-UHFFFAOYSA-N
Molecular Weight 230.307 g/mol
SMILES OC(C12CCC(CC2)(CC1)c1ccccc1)=O
SPLASH splash10-001i-6910000000-8dcc2980aa31983d919e
Wiley ID 1476462