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(1S*,6R*)-4,5-(4'-Methoxybenzo)bicyclo[4.2.0]oct-4-en-2-one
SpectraBase Compound ID GSzodRuY5yH
InChI InChI=1S/C13H14O2/c1-15-9-3-2-8-6-13(14)11-5-4-10(11)12(8)7-9/h2-3,7,10-11H,4-6H2,1H3/t10-,11+/m1/s1
InChIKey RXTJBTTWSYOAHL-MNOVXSKESA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hHCddTsLGp
Name (1S*,6R*)-4,5-(4'-Methoxybenzo)bicyclo[4.2.0]oct-4-en-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-15-9-3-2-8-6-13(14)11-5-4-10(11)12(8)7-9/h2-3,7,10-11H,4-6H2,1H3/t10-,11+/m1/s1
InChIKey RXTJBTTWSYOAHL-MNOVXSKESA-N
Molecular Weight 202.253 g/mol
SMILES c12[C@]3([C@@]([H])(C(Cc2ccc(c1)OC)=O)CC3)[H]
SPLASH splash10-00di-0590000000-87c76560da7ff08f1f8f
Source of Spectrum J-58-2802-7
Synonyms (2aS,8bR)-7-methoxy-2,2a,4,8b-tetrahydrocyclobuta[a]naphthalen-3(1H)-one
Wiley ID 1200109