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trans-2-methyl-3,8-oxomethano-bicyclo[6.4.0]undeca-4,6-diene
SpectraBase Compound ID I8PCDjBT9qP
InChI InChI=1S/C13H16O/c1-9-10-5-2-3-7-13(12(10)14)8-4-6-11(9)13/h2-3,5,7,9-11H,4,6,8H2,1H3/t9?,10?,11-,13+/m1/s1
InChIKey BTLSRKMNRVXJOM-KMFOADKKSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOGt4lmzg1
Name trans-2-methyl-3,8-oxomethano-bicyclo[6.4.0]undeca-4,6-diene
Comments Less than 3 mono-isotopic peaks
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Formula C13H16O
InChI InChI=1S/C13H16O/c1-9-10-5-2-3-7-13(12(10)14)8-4-6-11(9)13/h2-3,5,7,9-11H,4,6,8H2,1H3/t9?,10?,11-,13+/m1/s1
InChIKey BTLSRKMNRVXJOM-KMFOADKKSA-N
Molecular Weight 188.270 g/mol
SMILES [C@@]123C(C(C=CC=C3)C([C@]1(CCC2)[H])C)=O
SPLASH splash10-01p9-0900000000-091f30afbbd4cd9b08c5
Source of Spectrum J-54-599-16
Synonyms (1R,5R)-6-methyltricyclo[5.4.1.0(1,5)]dodeca-8,10-dien-12-one
Wiley ID 1185187