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Bicyclo[6.2.2]dodeca-8,10,11-triene-9,10-dicarboxylic acid
SpectraBase Compound ID 9blMOlgq5n1
InChI InChI=1S/C14H16O4/c15-13(16)11-9-5-3-1-2-4-6-10(8-7-9)12(11)14(17)18/h7-8H,1-6H2,(H,15,16)(H,17,18)
InChIKey NTTOQZHORKWLFW-UHFFFAOYSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Z8WWmSt49s
Name Bicyclo[6.2.2]dodeca-8,10,11-triene-9,10-dicarboxylic acid
Alternate Name(s) bicyclo[6.2.2]dodeca-1(10),8,11-triene-9,10-dicarboxylic acid [6]paracyclophan-8,9-dicarbonsaure (bicyclo[6.2.2]dodeca-8,10,11-trien-9,10-dicarbonsaure
CAS Registry Number 101410-38-2
Comments Less than 3 mono-isotopic peaks
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Formula C14H16O4
InChI InChI=1S/C14H16O4/c15-13(16)11-9-5-3-1-2-4-6-10(8-7-9)12(11)14(17)18/h7-8H,1-6H2,(H,15,16)(H,17,18)
InChIKey NTTOQZHORKWLFW-UHFFFAOYSA-N
Molecular Weight 248.278 g/mol
SMILES OC(c1c(C(=O)O)c2CCCCCCc1cc2)=O
SPLASH splash10-00di-0900000000-d46135306f0290091523
Source of Spectrum K-118-4159-2
Wiley ID 1251074