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2-Acetyl-9-(tert-butoxycarbonyl)-5-iodo-9-azabicyclo[4.2.1]nonane
SpectraBase Compound ID CCsbD80WASe
InChI InChI=1S/C15H24INO3/c1-9(18)10-5-6-11(16)13-8-7-12(10)17(13)14(19)20-15(2,3)4/h10-13H,5-8H2,1-4H3/t10-,11?,12+,13-/m1/s1
InChIKey YQPMPTAZZWEDBN-IBSWDFHHSA-N
Mol Weight 393.27 g/mol
Molecular Formula C15H24INO3
Exact Mass 393.080089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10qwL19WDgc
Name 2-Acetyl-9-(tert-butoxycarbonyl)-5-iodo-9-azabicyclo[4.2.1]nonane
Alternate Name(s) (S)-2-Acetyl-9-(tert-butoxycarbonyl)-5-iodo-9-azabicyclo[4.2.1]nonane tert-Butyl 2-acetyl-5-iodo-9-azabicyclo[4.2.1]nonane-9-carboxylate
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Formula C15H24INO3
InChI InChI=1S/C15H24INO3/c1-9(18)10-5-6-11(16)13-8-7-12(10)17(13)14(19)20-15(2,3)4/h10-13H,5-8H2,1-4H3/t10-,11?,12+,13-/m1/s1
InChIKey YQPMPTAZZWEDBN-IBSWDFHHSA-N
Molecular Weight 393.265 g/mol
SMILES C(N1[C@@]2([C@](CCC([C@]1(CC2)[H])I)(C(=O)C)[H])[H])(OC(C)(C)C)=O
SPLASH splash10-07vi-5891000000-5ceeb3c1bb66ac54ba0f
Source of Spectrum F-52-11641-7
Wiley ID 798468