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E-2-Heptenoic acid, 3-iodo-
SpectraBase Compound ID KABYU4cdOHq
InChI InChI=1S/C7H11IO2/c1-2-3-4-6(8)5-7(9)10/h5H,2-4H2,1H3,(H,9,10)/b6-5-
InChIKey AHLQBEBTXHGXFA-WAYWQWQTSA-N
Mol Weight 254.07 g/mol
Molecular Formula C7H11IO2
Exact Mass 253.980375 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7jG9LhlFTB
Name E-2-Heptenoic acid, 3-iodo-
Alternate Name(s) (E/Z)3-Iodo-2-heptenoic acid (Z)-3-iodohept-2-enoic acid (Z)-3-iodo-2-heptenoic acid (Z)-3-iodanylhept-2-enoic acid
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Formula C7H11IO2
InChI InChI=1S/C7H11IO2/c1-2-3-4-6(8)5-7(9)10/h5H,2-4H2,1H3,(H,9,10)/b6-5-
InChIKey AHLQBEBTXHGXFA-WAYWQWQTSA-N
Literature Reference DOI 10.1002/cjoc.19970150210
Molecular Weight 254.067 g/mol
SMILES OC(\C=C\(CCCC)I)=O
SPLASH splash10-0059-6970000000-c6039d522c44aa082ff8
Source of Spectrum CJC-15-158-5a
Wiley ID 1773323