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(7,7-Dimethyl-2-exo-phenylselenylbicyclo[2.2.1]hept-1-yl)methane sulfonic acid phenyl ester
SpectraBase Compound ID CbEJNyxW4ze
InChI InChI=1S/C22H26O3SSe/c1-21(2)17-13-14-22(21,20(15-17)27-19-11-7-4-8-12-19)16-26(23,24)25-18-9-5-3-6-10-18/h3-12,17,20H,13-16H2,1-2H3/t17-,20+,22+/m0/s1
InChIKey CVHUOVIZZSWXOJ-UCNVEGJOSA-N
Mol Weight 449.48 g/mol
Molecular Formula C22H26O3SSe
Exact Mass 450.076788 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mfRXedHKsE
Name (7,7-Dimethyl-2-exo-phenylselenylbicyclo[2.2.1]hept-1-yl)methane sulfonic acid phenyl ester
Alternate Name(s) (1R,2R)-(7,7-Dimethyl-2-exo-phenylselenylbicyclo[2.2.1]hept-1-yl)methane sulfonic acid phenyl ester phenyl[7,7-dimethyl-2-(phenylselanyl)bicyclo[2.2.1]hept-1-yl]methanesulfonate
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Formula C22H26O3SSe
InChI InChI=1S/C22H26O3SSe/c1-21(2)17-13-14-22(21,20(15-17)27-19-11-7-4-8-12-19)16-26(23,24)25-18-9-5-3-6-10-18/h3-12,17,20H,13-16H2,1-2H3/t17-,20+,22+/m0/s1
InChIKey CVHUOVIZZSWXOJ-UCNVEGJOSA-N
Molecular Weight 449.479 g/mol
SMILES [C@]12(C([C@@](CC2)(C[C@]1([Se]c1ccccc1)[H])[H])(C)C)CS(Oc1ccccc1)(=O)=O
SPLASH splash10-000l-5910000000-dde28337ca6b2f090025
Source of Spectrum F-55-9616-8
Wiley ID 838633