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(2Z,3E)-Dimethyl 3-iodo-hex-2,4-diendioate
SpectraBase Compound ID CmLfbe5zVtD
InChI InChI=1S/C8H9IO4/c1-12-7(10)4-3-6(9)5-8(11)13-2/h3-5H,1-2H3/b4-3+,6-5-
InChIKey JFDMXGGSBMSMAS-ICWBMWKASA-N
Mol Weight 296.06 g/mol
Molecular Formula C8H9IO4
Exact Mass 295.954554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BODzQxdowvq
Name (2Z,3E)-Dimethyl 3-iodo-hex-2,4-diendioate
Appearance Orange oil
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Exact Mass 295.954553766 u
Formula C8H9IO4
InChI InChI=1S/C8H9IO4/c1-12-7(10)4-3-6(9)5-8(11)13-2/h3-5H,1-2H3/b4-3+,6-5-
InChIKey JFDMXGGSBMSMAS-ICWBMWKASA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201900323
Molecular Weight 296.060 g/mol
Quality 8
Reported Formula C7H9IO4
SMILES C(OC)(=O)\C=C\(\C=C\C(=O)OC)I
SPLASH splash10-00kb-0790000000-6326c457a39467824c0e
Source of Spectrum QE-25-SM7-2h (DOI: 10.1002/chem.201900323)
Thin-Layer Chromatography 0.6 (hexanes/EtOAc, 7:3)
Wiley ID 1893708