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11,11-dimethyl-1-azonia-9-azapentacyclo[7.3.0.0(2,7).0(4,12).0(5,10)]dodecane iodide
SpectraBase Compound ID 3Wepv9xKzSY
InChI InChI=1S/C12H18N2.HI/c1-12(2)10-7-3-6-5-13(10)14-9(6)4-8(7)11(12)14;/h6-11H,3-5H2,1-2H3;1H/t6-,7-,8+,9-,10-,11+;/m0./s1
InChIKey PJCBXFHBKJVJNI-NQRZZZPISA-N
Mol Weight 318.2 g/mol
Molecular Formula C12H19IN2
Exact Mass 318.059294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5bzqHhEAc7a
Name 11,11-dimethyl-1-azonia-9-azapentacyclo[7.3.0.0(2,7).0(4,12).0(5,10)]dodecane iodide
Alternate Name(s) 11,11-Dimethyl-1-azonia-9-azapentacyclo[7.3.0.0(2,7).0(5,10)]dodecane iodide 7,7-Dimethyl-1-aza-2-azoniapentacyclo[6.4.0.0(2,6).0(3,11).0(5,9)]dodecane iodide
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Formula C12H19IN2
InChI InChI=1S/C12H18N2.HI/c1-12(2)10-7-3-6-5-13(10)14-9(6)4-8(7)11(12)14;/h6-11H,3-5H2,1-2H3;1H/t6-,7-,8+,9-,10-,11+;/m0./s1
InChIKey PJCBXFHBKJVJNI-NQRZZZPISA-N
Molecular Weight 318.202 g/mol
SMILES [I-].[NH+]12[C@@]3([C@]4(C[C@]5([C@]([C@@]1(C([C@]5(N2C4)[H])(C)C)[H])(C3)[H])[H])[H])[H]
SPLASH splash10-004i-2900000000-2707e3af7a0b4f616a26
Source of Spectrum F-44-3304-3
Wiley ID 1317997