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2,6-Dibromo-4-formylphenyl 3,5-dinitrobenzoate
SpectraBase Compound ID 2dBrdGHNnFy
InChI InChI=1S/C14H6Br2N2O7/c15-11-1-7(6-19)2-12(16)13(11)25-14(20)8-3-9(17(21)22)5-10(4-8)18(23)24/h1-6H
InChIKey URHBBBHRFLYRQO-UHFFFAOYSA-N
Mol Weight 474.02 g/mol
Molecular Formula C14H6Br2N2O7
Exact Mass 471.854177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FW5S6VV5oAQ
Name 2,6-Dibromo-4-formylphenyl 3,5-dinitrobenzoate
Alternate Name(s) 3,5-Dinitrobenzoic acid (2,6-dibromo-4-formyl-phenyl) ester 3,5-Dinitrobenzoic acid (2,6-dibromo-4-formylphenyl) ester (2,6-dibromo-4-formylphenyl) 3,5-dinitrobenzoate (2,6-dibromo-4-formyl-phenyl) 3,5-dinitrobenzoate
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Formula C14H6Br2N2O7
InChI InChI=1S/C14H6Br2N2O7/c15-11-1-7(6-19)2-12(16)13(11)25-14(20)8-3-9(17(21)22)5-10(4-8)18(23)24/h1-6H
InChIKey URHBBBHRFLYRQO-UHFFFAOYSA-N
Molecular Weight 474.017 g/mol
SMILES C(=O)c1cc(c(OC(c2cc(N(=O)=O)cc(N(=O)=O)c2)=O)c(c1)Br)Br
SPLASH splash10-01r2-9500000000-8fb84baa1d571d26f7f4
Wiley ID 1443957