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(1S*,6R*)-4,5-(4'-Hydroxybenzo)bicyclo[4.2.0]oct-4-en-2-one
SpectraBase Compound ID BNxm5xBpG0e
InChI InChI=1S/C12H12O2/c13-8-1-2-9-7(5-8)6-12(14)11-4-3-10(9)11/h1-2,5,10-11,13H,3-4,6H2/t10-,11-/m0/s1
InChIKey ILCPFSKQEZMYMU-QWRGUYRKSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ER1tqiIxlS
Name (1S*,6R*)-4,5-(4'-Hydroxybenzo)bicyclo[4.2.0]oct-4-en-2-one
Alternate Name(s) (2aS,8bR)-6-hydroxy-2,2a,4,8b-tetrahydrocyclobuta[a]naphthalen-3(1H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H12O2
InChI InChI=1S/C12H12O2/c13-8-1-2-9-7(5-8)6-12(14)11-4-3-10(9)11/h1-2,5,10-11,13H,3-4,6H2/t10-,11-/m0/s1
InChIKey ILCPFSKQEZMYMU-QWRGUYRKSA-N
Molecular Weight 188.226 g/mol
SMILES Oc1ccc2[C@]3([C@](C(Cc2c1)=O)([H])CC3)[H]
SPLASH splash10-03di-0900000000-3d38a57f6ecd4a2e6dc8
Source of Spectrum J-58-2802-7
Wiley ID 1184977