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1-(4-Methyl-3,5-dinitrophenyl)-1H-1,2,3-triazole
SpectraBase Compound ID Ceitm26kwQL
InChI InChI=1S/C9H7N5O4/c1-6-8(13(15)16)4-7(5-9(6)14(17)18)12-3-2-10-11-12/h2-5H,1H3
InChIKey BAXRNAVFFVWMQT-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 DnjKVPJ4S8X
Name 1-(4-Methyl-3,5-dinitrophenyl)-1H-1,2,3-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N5O4
InChI InChI=1S/C9H7N5O4/c1-6-8(13(15)16)4-7(5-9(6)14(17)18)12-3-2-10-11-12/h2-5H,1H3
InChIKey BAXRNAVFFVWMQT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ajoc.201500390
Molecular Weight 249.186 g/mol
SMILES c1nn[n](c1)-c1cc(c(c(c1)[N+](=O)[O-])C)[N+](=O)[O-]
SPLASH splash10-0udi-0190000000-6181e3fb79ccf8daf955
Source of Spectrum AJO-5-138/SM23-23b
Wiley ID 1798788