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Methyl 3'-Benzoyl[2]Staffane-3-carboxylate
SpectraBase Compound ID BFoIRrbRYRU
InChI InChI=1S/C19H20O3/c1-22-15(21)17-10-19(11-17,12-17)18-7-16(8-18,9-18)14(20)13-5-3-2-4-6-13/h2-6H,7-12H2,1H3
InChIKey LQNOHCJELGVCDD-UHFFFAOYSA-N
Mol Weight 296.37 g/mol
Molecular Formula C19H20O3
Exact Mass 296.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7OW66VNWJvz
Name Methyl 3'-Benzoyl[2]Staffane-3-carboxylate
Alternate Name(s) Methyl 3-{3-benzoylbicyclo[1.1.1]pentan-1-yl}bicyclo[1.1.1]pentane-1-carboxylate
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Formula C19H20O3
InChI InChI=1S/C19H20O3/c1-22-15(21)17-10-19(11-17,12-17)18-7-16(8-18,9-18)14(20)13-5-3-2-4-6-13/h2-6H,7-12H2,1H3
InChIKey LQNOHCJELGVCDD-UHFFFAOYSA-N
Molecular Weight 296.366 g/mol
SMILES C12(C34CC(C4)(C(=O)c4ccccc4)C3)CC(C2)(C(=O)OC)C1
SPLASH splash10-0a6r-9800000000-3e5ffcffa07c22093f74
Source of Spectrum C-114-614-2
Wiley ID 1299470