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1-(5-Methyl-2,4-dinitrophenyl)-1H-1,2,4-triazole
SpectraBase Compound ID 16msfIt1cJo
InChI InChI=1S/C9H7N5O4/c1-6-2-8(12-5-10-4-11-12)9(14(17)18)3-7(6)13(15)16/h2-5H,1H3
InChIKey RKOLPPJYXXSQNK-UHFFFAOYSA-N
Mol Weight 249.19 g/mol
Molecular Formula C9H7N5O4
Exact Mass 249.049804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OyPRmBsjCR
Name 1-(5-Methyl-2,4-dinitrophenyl)-1H-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N5O4
InChI InChI=1S/C9H7N5O4/c1-6-2-8(12-5-10-4-11-12)9(14(17)18)3-7(6)13(15)16/h2-5H,1H3
InChIKey RKOLPPJYXXSQNK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201300969
Molecular Weight 249.186 g/mol
SMILES c1n[n](cn1)-c1c(cc(c(c1)C)[N+](=O)[O-])[N+](=O)[O-]
SPLASH splash10-0vi1-9040000000-6347de697741b9acef85
Source of Spectrum CAJ-9-175-5c
Wiley ID 1772068