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6-Methoxy-2-phenyl-3-iodo-4H-1-benzopyran-4-one
SpectraBase Compound ID JwscIOxniWF
InChI InChI=1S/C16H11IO3/c1-19-11-7-8-13-12(9-11)15(18)14(17)16(20-13)10-5-3-2-4-6-10/h2-9H,1H3
InChIKey PZUZQBQVDVRUDY-UHFFFAOYSA-N
Mol Weight 378.17 g/mol
Molecular Formula C16H11IO3
Exact Mass 377.975289 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lxx9huMc0N
Name 6-Methoxy-2-phenyl-3-iodo-4H-1-benzopyran-4-one
Alternate Name(s) 3-iodo-6-methoxy-2-phenyl-4H-chromen-4-one 6-Methoxy-2-phenyl-3-iodo-4H-1-benzopyran 3-iodo-6-methoxy-2-phenyl-1-benzopyran-4-one 3-iodo-6-methoxy-2-phenylchromen-4-one 3-iodo-6-methoxy-2-phenyl-chromen-4-one 3-iodanyl-6-methoxy-2-phenyl-chromen-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H11IO3
InChI InChI=1S/C16H11IO3/c1-19-11-7-8-13-12(9-11)15(18)14(17)16(20-13)10-5-3-2-4-6-10/h2-9H,1H3
InChIKey PZUZQBQVDVRUDY-UHFFFAOYSA-N
Molecular Weight 378.165 g/mol
SMILES C1(=C(Oc2c(C1=O)cc(cc2)OC)c1ccccc1)I
SPLASH splash10-004i-0029000000-d337846672162ff87ce9
Source of Spectrum SO-0-566-2
Wiley ID 1544159