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6-Bromanyl-3-(2,4-dinitrobutyl)-5-methoxy-1H-indole
SpectraBase Compound ID K16BMuKJ0EQ
InChI InChI=1S/C13H14BrN3O5/c1-22-13-5-10-8(7-15-12(10)6-11(13)14)4-9(17(20)21)2-3-16(18)19/h5-7,9,15H,2-4H2,1H3
InChIKey KBNYKOFKVBFBEB-UHFFFAOYSA-N
Mol Weight 372.18 g/mol
Molecular Formula C13H14BrN3O5
Exact Mass 371.011684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24DgkCAOeGJ
Name 6-Bromanyl-3-(2,4-dinitrobutyl)-5-methoxy-1H-indole
Alternate Name(s) 6-Bromo-3-(2,4-dinitrobutyl)-5-methoxy-1H-indole
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Formula C13H14BrN3O5
InChI InChI=1S/C13H14BrN3O5/c1-22-13-5-10-8(7-15-12(10)6-11(13)14)4-9(17(20)21)2-3-16(18)19/h5-7,9,15H,2-4H2,1H3
InChIKey KBNYKOFKVBFBEB-UHFFFAOYSA-N
Molecular Weight 372.175 g/mol
SMILES [nH]1c2cc(c(cc2c(c1)CC(CCN(=O)=O)N(=O)=O)OC)Br
SPLASH splash10-007c-0095000000-1134bbe45af0897a3206
Source of Spectrum E1-38-63-24
Wiley ID 1518051