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10,11-Benzo[3.2]paracyclophane-4'-carboxylic acid

View entire compound with spectra: 1 NMR, and 3 MS (GC)

10,11-Benzo[3.2]paracyclophane-4'-carboxylic acid
SpectraBase Compound ID 75Fv7xbQxgC
InChI InChI=1S/C22H18O2/c23-22(24)19-12-13-20-17-8-4-15(5-9-17)2-1-3-16-6-10-18(11-7-16)21(20)14-19/h4-14H,1-3H2,(H,23,24)
InChIKey CKFAJWBTIYVTGP-UHFFFAOYSA-N
Mol Weight 314.38 g/mol
Molecular Formula C22H18O2
Exact Mass 314.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmDucVwjirY
Name 10,11-Benzo[3.2]paracyclophane-4'-carboxylic acid
CAS Registry Number 121732-63-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18O2
InChI InChI=1S/C22H18O2/c23-22(24)19-12-13-20-17-8-4-15(5-9-17)2-1-3-16-6-10-18(11-7-16)21(20)14-19/h4-14H,1-3H2,(H,23,24)
InChIKey CKFAJWBTIYVTGP-UHFFFAOYSA-N
Molecular Weight 314.384 g/mol
SMILES OC(c1cc-2c(cc1)-c1ccc(cc1)CCCc1ccc2cc1)=O
SPLASH splash10-03di-4494000000-49086ba8c0b0ca634666
Wiley ID 1476819