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5-Hydroxy-2-iodo-4-methoxyphenyl acetate
SpectraBase Compound ID CthkwaKJzSl
InChI InChI=1S/C9H9IO4/c1-5(11)14-8-4-7(12)9(13-2)3-6(8)10/h3-4,12H,1-2H3
InChIKey LWZQQQJPFYMQFP-UHFFFAOYSA-N
Mol Weight 308.07 g/mol
Molecular Formula C9H9IO4
Exact Mass 307.954554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51F3wFSE8CL
Name 5-Hydroxy-2-iodo-4-methoxyphenyl acetate
Alternate Name(s) acetic acid (5-hydroxy-2-iodo-4-methoxyphenyl) ester (5-hydroxy-2-iodo-4-methoxyphenyl) acetate (5-hydroxy-2-iodo-4-methoxy-phenyl) acetate (2-iodanyl-4-methoxy-5-oxidanyl-phenyl) ethanoate
Comments Less than 3 mono-isotopic peaks
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Formula C9H9IO4
InChI InChI=1S/C9H9IO4/c1-5(11)14-8-4-7(12)9(13-2)3-6(8)10/h3-4,12H,1-2H3
InChIKey LWZQQQJPFYMQFP-UHFFFAOYSA-N
Molecular Weight 308.071 g/mol
SMILES Oc1cc(c(cc1OC)I)OC(=O)C
SPLASH splash10-014i-0093000000-2d64ef1d023a51284962
Source of Spectrum J-63-9142-19
Wiley ID 1309291