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(7,7-Dimethyl-2-exo-benzylselenylbicyclo[2.2.1]hept-1-yl)methane sulfonic acid phenyl ester
SpectraBase Compound ID B9f0ncDRWIK
InChI InChI=1S/C23H28O3SSe/c1-22(2)19-13-14-23(22,17-27(24,25)26-20-11-7-4-8-12-20)21(15-19)28-16-18-9-5-3-6-10-18/h3-12,19,21H,13-17H2,1-2H3/t19-,21+,23+/m0/s1
InChIKey NQERVMBEHRDRHE-XKCSPQBFSA-N
Mol Weight 463.51 g/mol
Molecular Formula C23H28O3SSe
Exact Mass 464.092438 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FrAq1NukgW
Name (7,7-Dimethyl-2-exo-benzylselenylbicyclo[2.2.1]hept-1-yl)methane sulfonic acid phenyl ester
Alternate Name(s) (1R,2R)-(7,7-Dimethyl-2-exo-benzylselenylbicyclo[2.2.1]hept-1-yl)methane sulfonic acid phenyl ester phenyl[2-(benzylselanyl)-7,7-dimethylbicyclo[2.2.1]hept-1-yl]methanesulfonate
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Formula C23H28O3SSe
InChI InChI=1S/C23H28O3SSe/c1-22(2)19-13-14-23(22,17-27(24,25)26-20-11-7-4-8-12-20)21(15-19)28-16-18-9-5-3-6-10-18/h3-12,19,21H,13-17H2,1-2H3/t19-,21+,23+/m0/s1
InChIKey NQERVMBEHRDRHE-XKCSPQBFSA-N
Molecular Weight 463.506 g/mol
SMILES [C@]12(C([C@@](CC2)(C[C@]1([Se]Cc1ccccc1)[H])[H])(C)C)CS(Oc1ccccc1)(=O)=O
SPLASH splash10-000l-8910100000-45fcf32343432e5c2846
Source of Spectrum F-55-9617-9
Wiley ID 838631