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2-Benzyloxy-1-iodo-4,6-dinitrobenzene
SpectraBase Compound ID yJ6KLGfH3e
InChI InChI=1S/C13H9IN2O5/c14-13-11(16(19)20)6-10(15(17)18)7-12(13)21-8-9-4-2-1-3-5-9/h1-7H,8H2
InChIKey QZVVGADJQJEHSB-UHFFFAOYSA-N
Mol Weight 400.13 g/mol
Molecular Formula C13H9IN2O5
Exact Mass 399.955616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3aG0cJhczk
Name 2-Benzyloxy-1-iodo-4,6-dinitrobenzene
Comments Less than 3 mono-isotopic peaks
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Formula C13H9IN2O5
InChI InChI=1S/C13H9IN2O5/c14-13-11(16(19)20)6-10(15(17)18)7-12(13)21-8-9-4-2-1-3-5-9/h1-7H,8H2
InChIKey QZVVGADJQJEHSB-UHFFFAOYSA-N
Molecular Weight 400.128 g/mol
SMILES c1(c(cc(cc1N(=O)=O)N(=O)=O)OCc1ccccc1)I
SPLASH splash10-0006-9000000000-ab5b5a7c0c47061638ee
Source of Spectrum KC-61-12335-18
Synonyms 1-(benzyloxy)-2-iodo-3,5-dinitrobenzene benzyl 2-iodo-3,5-dinitrophenyl ether
Wiley ID 1631675