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2-(2,6-Dinitro-4-(trifluoromethyl)phenyl)-4-nitro-2H-1,2,3-triazole
SpectraBase Compound ID ghvvR81SM0
InChI InChI=1S/C9H3F3N6O6/c10-9(11,12)4-1-5(16(19)20)8(6(2-4)17(21)22)15-13-3-7(14-15)18(23)24/h1-3H
InChIKey KUFSMYTZWDSVJP-UHFFFAOYSA-N
Mol Weight 348.15 g/mol
Molecular Formula C9H3F3N6O6
Exact Mass 348.006616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SlaEkmqtCK
Name 2-(2,6-Dinitro-4-(trifluoromethyl)phenyl)-4-nitro-2H-1,2,3-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H3F3N6O6
InChI InChI=1S/C9H3F3N6O6/c10-9(11,12)4-1-5(16(19)20)8(6(2-4)17(21)22)15-13-3-7(14-15)18(23)24/h1-3H
InChIKey KUFSMYTZWDSVJP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ajoc.201500390
Molecular Weight 348.154 g/mol
SMILES c1(n[n](nc1)-c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]
SPLASH splash10-0002-0239000000-5e86ef995a0b7b90f9c1
Source of Spectrum AJO-5-138/SM14-5h
Wiley ID 1798797