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(5R,6S)-6-(2-Iodo-ethyl)-1,5,6-trimethyl-cyclohexene
SpectraBase Compound ID 9r3Naq5dMxI
InChI InChI=1S/C11H19I/c1-9-5-4-6-10(2)11(9,3)7-8-12/h5,10H,4,6-8H2,1-3H3/t10-,11-/m1/s1
InChIKey ZPIOHVHPNQTBGT-GHMZBOCLSA-N
Mol Weight 278.18 g/mol
Molecular Formula C11H19I
Exact Mass 278.053146 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EiC5EvOGa0E
Name (5R,6S)-6-(2-Iodo-ethyl)-1,5,6-trimethyl-cyclohexene
Alternate Name(s) 6-(2'-Iodoethyl)-1,5,6-trimethylcyclohex-1-ene (5R,6S)-6-(2-iodoethyl)-1,5,6-trimethylcyclohexene (5R,6S)-6-(2-iodanylethyl)-1,5,6-trimethyl-cyclohexene
Comments Less than 3 mono-isotopic peaks
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Formula C11H19I
InChI InChI=1S/C11H19I/c1-9-5-4-6-10(2)11(9,3)7-8-12/h5,10H,4,6-8H2,1-3H3/t10-,11-/m1/s1
InChIKey ZPIOHVHPNQTBGT-GHMZBOCLSA-N
Molecular Weight 278.177 g/mol
SMILES [C@@]1(C(=CCC[C@]1(C)[H])C)(CCI)C
SPLASH splash10-00di-0940000000-bd21f54ccf4a3058a4a3
Source of Spectrum QE-15-915-5
Wiley ID 1692654