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1-(2,4-Dinitro-6-(trifluoromethyl)phenyl)-1H-1,2,3-triazole
SpectraBase Compound ID AxpYWIBW4mt
InChI InChI=1S/C9H4F3N5O4/c10-9(11,12)6-3-5(16(18)19)4-7(17(20)21)8(6)15-2-1-13-14-15/h1-4H
InChIKey CSECLSPSKMGOHG-UHFFFAOYSA-N
Mol Weight 303.16 g/mol
Molecular Formula C9H4F3N5O4
Exact Mass 303.021538 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HskDzCXGyjr
Name 1-(2,4-Dinitro-6-(trifluoromethyl)phenyl)-1H-1,2,3-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H4F3N5O4
InChI InChI=1S/C9H4F3N5O4/c10-9(11,12)6-3-5(16(18)19)4-7(17(20)21)8(6)15-2-1-13-14-15/h1-4H
InChIKey CSECLSPSKMGOHG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ajoc.201500390
Molecular Weight 303.157 g/mol
SMILES c1nn[n](c1)-c1c(cc(cc1C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]
SPLASH splash10-0udi-0019000000-d4fe6d746efa83fe2752
Source of Spectrum AJO-5-138/SM18-13
Wiley ID 1798782