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1,1'-Bis[5-iodomethyl-2-methyl-3,4-dihydro-5H-pyrrol-1-yloxy]hydro iodide salt
SpectraBase Compound ID BNDQRAAbb2s
InChI InChI=1S/C10H19N2O2.2CH4.3HI/c1-9-5-3-7-11(9)13-15-14-12-8-4-6-10(12)2;;;;;/h3-8H2,1-2H3;2*1H4;3*1H/q+1;;;;;/p-1
InChIKey MKYIRUKAPRWPTP-UHFFFAOYSA-M
Mol Weight 614.09 g/mol
Molecular Formula C12H29I3N2O2
Exact Mass 613.936313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PxyVUA00U8
Name 1,1'-Bis[5-iodomethyl-2-methyl-3,4-dihydro-5H-pyrrol-1-yloxy]hydro iodide salt
Comments Less than 3 mono-isotopic peaks
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Formula C12H21I3N2O2
InChI InChI=1S/C10H19N2O2.2CH4.3HI/c1-9-5-3-7-11(9)13-15-14-12-8-4-6-10(12)2;;;;;/h3-8H2,1-2H3;2*1H4;3*1H/q+1;;;;;/p-1
InChIKey MKYIRUKAPRWPTP-UHFFFAOYSA-M
Molecular Weight 614.089 g/mol
SMILES [I-].C1(=[N+](CCC1)[O-][H+][O-][N+]=1CCCC1C)C.C.I.C.I
SPLASH splash10-0006-0090000000-36f660b651f49b017722
Source of Spectrum KC-57-1123-3
Wiley ID 1622880