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Bicyclo[4.4.1]undeca-2,4,6,8,10-pentaene-3-carboxylic acid, ethyl ester
SpectraBase Compound ID E9iXtU9Ies
InChI InChI=1S/C14H14O2/c1-2-16-14(15)13-8-7-11-5-3-4-6-12(9-11)10-13/h3-8,10H,2,9H2,1H3
InChIKey GUJOBXBCCBEHNG-UHFFFAOYSA-N
Mol Weight 214.26 g/mol
Molecular Formula C14H14O2
Exact Mass 214.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ij4TVGOV2fs
Name Bicyclo[4.4.1]undeca-2,4,6,8,10-pentaene-3-carboxylic acid, ethyl ester
CAS Registry Number 126703-82-0
Comments Less than 3 mono-isotopic peaks
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Formula C14H14O2
InChI InChI=1S/C14H14O2/c1-2-16-14(15)13-8-7-11-5-3-4-6-12(9-11)10-13/h3-8,10H,2,9H2,1H3
InChIKey GUJOBXBCCBEHNG-UHFFFAOYSA-N
Molecular Weight 214.264 g/mol
SMILES C1(=CC2=CC=CC=C(C=C1)C2)C(=O)OCC
SPLASH splash10-0006-0920000000-67848908ce56f7081e14
Source of Spectrum H-72-1317-9
Synonyms ethyl bicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaene-3-carboxylate Methyl bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene-3-carboxylate
Wiley ID 1213996