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4-Heptyl-4'-biphenylcarboxylic acid
SpectraBase Compound ID 9QOvpSNhoSn
InChI InChI=1S/C20H24O2/c1-2-3-4-5-6-7-16-8-10-17(11-9-16)18-12-14-19(15-13-18)20(21)22/h8-15H,2-7H2,1H3,(H,21,22)
InChIKey XVROSBHWACAQRL-UHFFFAOYSA-N
Mol Weight 296.41 g/mol
Molecular Formula C20H24O2
Exact Mass 296.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CO5WJC9JbmA
Name 4-Heptyl-4'-biphenylcarboxylic acid
Alternate Name(s) 4-(4-heptylphenyl)benzoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C20H24O2
InChI InChI=1S/C20H24O2/c1-2-3-4-5-6-7-16-8-10-17(11-9-16)18-12-14-19(15-13-18)20(21)22/h8-15H,2-7H2,1H3,(H,21,22)
InChIKey XVROSBHWACAQRL-UHFFFAOYSA-N
Molecular Weight 296.410 g/mol
SMILES OC(c1ccc(cc1)-c1ccc(cc1)CCCCCCC)=O
SPLASH splash10-03dj-0090000000-9607637173d292c7cbbc
Source of Spectrum J-62-7046-0
Wiley ID 1299675