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Tricyclo[12.2.2.2*6,9*]icosa-1(17),6,8,14(18),15,19-hexaene-7-carboxylic acid
SpectraBase Compound ID 2KfVIACitFh
InChI InChI=1S/C21H24O2/c22-21(23)20-15-18-7-2-1-5-16-9-11-17(12-10-16)6-3-4-8-19(20)14-13-18/h9-15H,1-8H2,(H,22,23)
InChIKey TZQLLWGNLMUVEW-UHFFFAOYSA-N
Mol Weight 308.42 g/mol
Molecular Formula C21H24O2
Exact Mass 308.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqTheYbZyAy
Name Tricyclo[12.2.2.2*6,9*]icosa-1(17),6,8,14(18),15,19-hexaene-7-carboxylic acid
Alternate Name(s) [4.4]paracyclophane-6-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O2
InChI InChI=1S/C21H24O2/c22-21(23)20-15-18-7-2-1-5-16-9-11-17(12-10-16)6-3-4-8-19(20)14-13-18/h9-15H,1-8H2,(H,22,23)
InChIKey TZQLLWGNLMUVEW-UHFFFAOYSA-N
Molecular Weight 308.421 g/mol
SMILES OC(c1c2ccc(c1)CCCCc1ccc(CCCC2)cc1)=O
SPLASH splash10-0a4i-2924000000-a12ce3955008ef0cd268
Source of Spectrum U1-2009-247-27
Wiley ID 1662367