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Ethyl 1-(3-fluoro-2-iodophenyl)-2-oxocyclopentane-1-carboxylate
SpectraBase Compound ID 3aGfmjkbhNz
InChI InChI=1S/C14H14FIO3/c1-2-19-13(18)14(8-4-7-11(14)17)9-5-3-6-10(15)12(9)16/h3,5-6H,2,4,7-8H2,1H3
InChIKey UPWOSCYJSKLHGR-UHFFFAOYSA-N
Mol Weight 376.17 g/mol
Molecular Formula C14H14FIO3
Exact Mass 375.997167 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EUGnEGho8c
Name Ethyl 1-(3-fluoro-2-iodophenyl)-2-oxocyclopentane-1-carboxylate
Appearance Colorless oil
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Formula C14H14FIO3
InChI InChI=1S/C14H14FIO3/c1-2-19-13(18)14(8-4-7-11(14)17)9-5-3-6-10(15)12(9)16/h3,5-6H,2,4,7-8H2,1H3
InChIKey UPWOSCYJSKLHGR-UHFFFAOYSA-N
Instrument Name Thermo Scientific DFS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201905570
Molecular Weight 376.166 g/mol
Reported Formula C14H14FIO3
SMILES C1CCC(C1(C(OCC)=O)c1c(c(ccc1)F)I)=O
SPLASH splash10-0ums-0920000000-90eee49abffacfb4e7db
Source of Spectrum QE-26-SM18-5j
Thin-Layer Chromatography Rf = 0.21 (hexanes/MTBE, 5:1)
Wiley ID 1858620