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Tricyclo[9.2.2.2*4,7*]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaene-5-carboxylic acid
SpectraBase Compound ID 2j2u8wW0azO
InChI InChI=1S/C18H18O2/c19-18(20)17-12-15-3-1-2-13-4-6-14(7-5-13)8-10-16(17)11-9-15/h4-7,9,11-12H,1-3,8,10H2,(H,19,20)
InChIKey GCVRPFXIZLUILT-UHFFFAOYSA-N
Mol Weight 266.34 g/mol
Molecular Formula C18H18O2
Exact Mass 266.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28kf0uL308z
Name Tricyclo[9.2.2.2*4,7*]heptadeca-1(14),4(17),5,7(16),11(15),12-hexaene-5-carboxylic acid
Alternate Name(s) [3.2]paracyclophane-6-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O2
InChI InChI=1S/C18H18O2/c19-18(20)17-12-15-3-1-2-13-4-6-14(7-5-13)8-10-16(17)11-9-15/h4-7,9,11-12H,1-3,8,10H2,(H,19,20)
InChIKey GCVRPFXIZLUILT-UHFFFAOYSA-N
Molecular Weight 266.340 g/mol
SMILES OC(c1c2ccc(c1)CCCc1ccc(CC2)cc1)=O
SPLASH splash10-066r-0940000000-b30274c7fb06fe90fe81
Source of Spectrum U1-2009-246-24
Wiley ID 1662369