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5-(.beta.-Aminoethyl)-1-(p-nitrophenyl)-1,2,4-triazole - dihydrobromide
SpectraBase Compound ID 3Behxh7Cako
InChI InChI=1S/C10H11N5O2.2BrH/c11-6-5-10-12-7-13-14(10)8-1-3-9(4-2-8)15(16)17;;/h1-4,7H,5-6,11H2;2*1H
InChIKey YLKCPDHXOWUPNF-UHFFFAOYSA-N
Mol Weight 395.055 g/mol
Molecular Formula C10H13Br2N5O2
Exact Mass 392.943601 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgIgvfkZf7G
Name 5-(.beta.-Aminoethyl)-1-(p-nitrophenyl)-1,2,4-triazole - dihydrobromide
Alternate Name(s) 2-[1-(4-nitrophenyl)-1H-1,2,4-triazol-5-yl]ethan-1-amine dihydrobromide
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Formula C10H13Br2N5O2
InChI InChI=1S/C10H11N5O2.2BrH/c11-6-5-10-12-7-13-14(10)8-1-3-9(4-2-8)15(16)17;;/h1-4,7H,5-6,11H2;2*1H
InChIKey YLKCPDHXOWUPNF-UHFFFAOYSA-N
Molecular Weight 395.055 g/mol
SMILES Br.NCCc1[n](ncn1)-c1ccc(N(=O)=O)cc1.Br
SPLASH splash10-001i-9010000000-9985c83474461fd9b1b2
Source of Spectrum D8-325-529-10
Wiley ID 1514423