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3-[(2-Iodophenyl)methoxy]-2-cyclohexen-1-one
SpectraBase Compound ID QRlOY4krgz
InChI InChI=1S/C13H13IO2/c14-13-7-2-1-4-10(13)9-16-12-6-3-5-11(15)8-12/h1-2,4,7-8H,3,5-6,9H2
InChIKey CGCWDZDOOGESJW-UHFFFAOYSA-N
Mol Weight 328.15 g/mol
Molecular Formula C13H13IO2
Exact Mass 327.996025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HhLRikoTj5w
Name 3-[(2-Iodophenyl)methoxy]-2-cyclohexen-1-one
Alternate Name(s) 3-((2-iodobenzyl)oxy)cyclohex-2-enone 3-[(2-iodophenyl)methoxy]-1-cyclohex-2-enone 3-[(2-iodophenyl)methoxy]cyclohex-2-en-1-one 3-[(2-iodanylphenyl)methoxy]cyclohex-2-en-1-one
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Formula C13H13IO2
InChI InChI=1S/C13H13IO2/c14-13-7-2-1-4-10(13)9-16-12-6-3-5-11(15)8-12/h1-2,4,7-8H,3,5-6,9H2
InChIKey CGCWDZDOOGESJW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo3018318
Molecular Weight 328.149 g/mol
SMILES c1cc(c(cc1)I)COC1=CC(CCC1)=O
SPLASH splash10-00or-3094000000-e084e4f14a35437f8696
Source of Spectrum J-77-10202-10c
Wiley ID 1747154