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(2Z)-3-hydroxy-2-(iodomethylidene)octanoic acid methyl ester
SpectraBase Compound ID FmHQ8eTiLv
InChI InChI=1S/C10H17IO3/c1-3-4-5-6-9(12)8(7-11)10(13)14-2/h7,9,12H,3-6H2,1-2H3/b8-7-
InChIKey QATWDXDLFJDWCZ-FPLPWBNLSA-N
Mol Weight 312.15 g/mol
Molecular Formula C10H17IO3
Exact Mass 312.022239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4z4tuUMLMRm
Name (2Z)-3-hydroxy-2-(iodomethylidene)octanoic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C10H17IO3
InChI InChI=1S/C10H17IO3/c1-3-4-5-6-9(12)8(7-11)10(13)14-2/h7,9,12H,3-6H2,1-2H3/b8-7-
InChIKey QATWDXDLFJDWCZ-FPLPWBNLSA-N
Molecular Weight 312.147 g/mol
SMILES OC(\C(C(=O)OC)=C\I)CCCCC
SPLASH splash10-0006-0090000000-90070c1047ca19c220d9
Source of Spectrum SO-0-587-3
Synonyms (Z)-2-(1-hydroxyhexyl)-3-iodo-acrylic acid methyl ester methyl (2Z)-2-(iodanylmethylidene)-3-oxidanyl-octanoate methyl (2Z)-3-hydroxy-2-(iodomethylene)octanoate methyl (2Z)-3-hydroxy-2-(iodomethylidene)octanoate
Wiley ID 873690