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Bicyclo[6.2.2]dodeca-8,10,11-triene-9-carboxylic acid, methyl ester, (.+-.)-
SpectraBase Compound ID 3D54BPv35Pc
InChI InChI=1S/C14H18O2/c1-16-14(15)13-10-11-6-4-2-3-5-7-12(13)9-8-11/h8-10H,2-7H2,1H3
InChIKey AJPWTKUYYMVVCL-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7m0jZDZ2fCw
Name Bicyclo[6.2.2]dodeca-8,10,11-triene-9-carboxylic acid, methyl ester, (.+-.)-
CAS Registry Number 97672-83-8
Comments Less than 3 mono-isotopic peaks
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Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-16-14(15)13-10-11-6-4-2-3-5-7-12(13)9-8-11/h8-10H,2-7H2,1H3
InChIKey AJPWTKUYYMVVCL-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES c1(C(=O)OC)c2ccc(c1)CCCCCC2
SPLASH splash10-03di-0940000000-1c813704c72d236d7b64
Source of Spectrum K-118-2008-4
Synonyms Methyl (+-)-Bicyclo[6.2.2]dodeca-1(10),8,11-triene-9-carboxylate Methyl (+-)-[6]paracyclophane-8-carboxylate methyl bicyclo[6.2.2]dodeca-1(10),8,11-triene-9-carboxylate
Wiley ID 1218003