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2-iodo-4-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)glutaric acid dimethyl ester
SpectraBase Compound ID CdWADIVIj3k
InChI InChI=1S/C12H12F9IO4/c1-25-7(23)5(3-6(22)8(24)26-2)4-9(13,14)10(15,16)11(17,18)12(19,20)21/h5-6H,3-4H2,1-2H3
InChIKey LHOUTQIJQOGDDM-UHFFFAOYSA-N
Mol Weight 518.11 g/mol
Molecular Formula C12H12F9IO4
Exact Mass 517.963657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LrFQMKcNLb2
Name 2-iodo-4-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)glutaric acid dimethyl ester
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Formula C12H12F9IO4
InChI InChI=1S/C12H12F9IO4/c1-25-7(23)5(3-6(22)8(24)26-2)4-9(13,14)10(15,16)11(17,18)12(19,20)21/h5-6H,3-4H2,1-2H3
InChIKey LHOUTQIJQOGDDM-UHFFFAOYSA-N
Molecular Weight 518.114 g/mol
SMILES C(C(C(F)(F)F)(F)F)(C(CC(C(=O)OC)CC(C(=O)OC)I)(F)F)(F)F
SPLASH splash10-0a4l-7109200000-70d2b04b007e6b6e2b2f
Source of Spectrum J-60-3471-10
Synonyms 2-iodo-4-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)pentanedioic acid dimethyl ester Dimethyl 2-iodanyl-4-[2,2,3,3,4,4,5,5,5-nonakis(fluoranyl)pentyl]pentanedioate Dimethyl 2-iodo-4-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)pentanedioate
Wiley ID 1401589