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10,10-Dimethyl-N-(2-bromo-1-oxoprop-2-en-1-yl)-3-thia-4-azatricyclo[5.2.1.0(1,5)]decane 3,3-dioxide
SpectraBase Compound ID G4t5dIj1lyu
InChI InChI=1S/C13H18BrNO3S/c1-8(14)11(16)15-10-6-9-4-5-13(10,12(9,2)3)7-19(15,17)18/h9-10H,1,4-7H2,2-3H3/t9-,10?,13-/m1/s1
InChIKey PXQDMPMSMBMUBJ-NDAPUWOLSA-N
Mol Weight 348.26 g/mol
Molecular Formula C13H18BrNO3S
Exact Mass 347.019078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gdrd0RyLVl
Name 10,10-Dimethyl-N-(2-bromo-1-oxoprop-2-en-1-yl)-3-thia-4-azatricyclo[5.2.1.0(1,5)]decane 3,3-dioxide
Alternate Name(s) 4-(2-bromoacryloyl)-10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.0(1,5)]decane 3,3-dioxide
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Formula C13H18BrNO3S
InChI InChI=1S/C13H18BrNO3S/c1-8(14)11(16)15-10-6-9-4-5-13(10,12(9,2)3)7-19(15,17)18/h9-10H,1,4-7H2,2-3H3/t9-,10?,13-/m1/s1
InChIKey PXQDMPMSMBMUBJ-NDAPUWOLSA-N
Molecular Weight 348.255 g/mol
SMILES [C@]123CS(N(C3C[C@@](CC1)(C2(C)C)[H])C(C(=C)Br)=O)(=O)=O
SPLASH splash10-0f79-0950000000-f35b771f9b6d2911d29a
Source of Spectrum QC-12-3360-14
Wiley ID 1634882