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(2Z)-3-hydroxy-2-(iodomethylidene)-3-(2-methylphenyl)butanoic acid ethyl ester
SpectraBase Compound ID 27Iql47QX8D
InChI InChI=1S/C14H17IO3/c1-4-18-13(16)12(9-15)14(3,17)11-8-6-5-7-10(11)2/h5-9,17H,4H2,1-3H3/b12-9+
InChIKey QVPWIBHVZHKYMA-FMIVXFBMSA-N
Mol Weight 360.19 g/mol
Molecular Formula C14H17IO3
Exact Mass 360.022239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2UiZUJdT9lc
Name (2Z)-3-hydroxy-2-(iodomethylidene)-3-(2-methylphenyl)butanoic acid ethyl ester
Alternate Name(s) (Z)-2-[1-hydroxy-1-(o-tolyl)ethyl]-3-iodo-acrylic acid ethyl ester Ethyl (2Z)-2-(iodanylmethylidene)-3-(2-methylphenyl)-3-oxidanyl-butanoate Ethyl (2Z)-3-hydroxy-2-(iodomethylene)-3-(o-tolyl)butanoate Ethyl (2Z)-3-hydroxy-2-(iodomethylidene)-3-(2-methylphenyl)butanoate
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Formula C14H17IO3
InChI InChI=1S/C14H17IO3/c1-4-18-13(16)12(9-15)14(3,17)11-8-6-5-7-10(11)2/h5-9,17H,4H2,1-3H3/b12-9+
InChIKey QVPWIBHVZHKYMA-FMIVXFBMSA-N
Molecular Weight 360.191 g/mol
SMILES OC(\C(C(=O)OCC)=C\I)(C)c1c(cccc1)C
SPLASH splash10-014i-0490000000-2da5f8319fb9940036f0
Source of Spectrum D1-2007-62-16
Wiley ID 1614400