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1,1'-Biphenyl, 3,5'-diiodo-6-methoxy-2'-methyl-4'-(1-methylethoxy)-2-nitro-
SpectraBase Compound ID FIxwuy2K7Pj
InChI InChI=1S/C17H17I2NO4/c1-9(2)24-15-7-10(3)11(8-13(15)19)16-14(23-4)6-5-12(18)17(16)20(21)22/h5-9H,1-4H3
InChIKey JIYBVLMMTIVEIJ-UHFFFAOYSA-N
Mol Weight 553.13 g/mol
Molecular Formula C17H17I2NO4
Exact Mass 552.924698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jp96XEnQy50
Name 1,1'-Biphenyl, 3,5'-diiodo-6-methoxy-2'-methyl-4'-(1-methylethoxy)-2-nitro-
CAS Registry Number 111220-43-0
Comments Less than 3 mono-isotopic peaks
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Formula C17H17I2NO4
InChI InChI=1S/C17H17I2NO4/c1-9(2)24-15-7-10(3)11(8-13(15)19)16-14(23-4)6-5-12(18)17(16)20(21)22/h5-9H,1-4H3
InChIKey JIYBVLMMTIVEIJ-UHFFFAOYSA-N
Molecular Weight 553.135 g/mol
SMILES c1(c(N(=O)=O)c(I)ccc1OC)-c1cc(I)c(cc1C)OC(C)C
SPLASH splash10-03di-0000090000-117ede821253ad59a94b
Source of Spectrum KC-1987-863-14
Synonyms 3,3'-diiodo-4-isopropoxy-6'-methoxy-6-methyl-2'-nitro-1,1'-biphenyl 3,5'-di-iodo-4'-isopropoxy-6-methoxy-2'-methyl-2-nitrobiphenyl
Wiley ID 1406055