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Methyl (camphorylseleno)-(R)-(3'-oxocyclohexyl)acetate
SpectraBase Compound ID 67jSzJC2J8n
InChI InChI=1S/C19H28O4Se/c1-18(2)13-7-8-19(18,15(21)10-13)11-24-16(17(22)23-3)12-5-4-6-14(20)9-12/h12-13,16H,4-11H2,1-3H3/t12-,13-,16?,19-/m1/s1
InChIKey PGRJQBBZJVESGN-HOPDXQPUSA-N
Mol Weight 399.4 g/mol
Molecular Formula C19H28O4Se
Exact Mass 400.115281 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bu9B4dgBBva
Name Methyl (camphorylseleno)-(R)-(3'-oxocyclohexyl)acetate
Alternate Name(s) Methyl (camphorylseleno)-(3'-oxocyclohexyl)acetate Methyl {[(7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methyl]selanyl}[(1R)-3-oxocyclohexyl]acetate
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Formula C19H28O4Se
InChI InChI=1S/C19H28O4Se/c1-18(2)13-7-8-19(18,15(21)10-13)11-24-16(17(22)23-3)12-5-4-6-14(20)9-12/h12-13,16H,4-11H2,1-3H3/t12-,13-,16?,19-/m1/s1
InChIKey PGRJQBBZJVESGN-HOPDXQPUSA-N
Molecular Weight 399.401 g/mol
SMILES [C@]12(C([C@](CC2)(CC1=O)[H])(C)C)C[Se]C(C(=O)OC)[C@]1(CC(=O)CCC1)[H]
SPLASH splash10-107r-3920000000-0a6b6c15979fe1aaff31
Source of Spectrum H-2005-549-5
Wiley ID 1562185