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1H-Benzimidazole, 2-ethyl-7-nitro-5-(trifluoromethyl)-, 3-oxide
SpectraBase Compound ID 7pyfC8ZtvqP
InChI InChI=1S/C10H8F3N3O3/c1-2-8-14-9-6(15(8)17)3-5(10(11,12)13)4-7(9)16(18)19/h3-4,14H,2H2,1H3
InChIKey CUQAGMWBDDOUKX-UHFFFAOYSA-N
Mol Weight 275.19 g/mol
Molecular Formula C10H8F3N3O3
Exact Mass 275.051776 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bv7vK025m9
Name 1H-Benzimidazole, 2-ethyl-7-nitro-5-(trifluoromethyl)-, 3-oxide
CAS Registry Number 51047-08-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8F3N3O3
InChI InChI=1S/C10H8F3N3O3/c1-2-8-14-9-6(15(8)17)3-5(10(11,12)13)4-7(9)16(18)19/h3-4,14H,2H2,1H3
InChIKey CUQAGMWBDDOUKX-UHFFFAOYSA-N
Molecular Weight 275.187 g/mol
SMILES [nH]1c2c([n+](c1CC)[O-])cc(cc2[N+]([O-])=O)C(F)(F)F
SPLASH splash10-0a4i-9370000000-a518ef468ae30032aed6
Source of Spectrum KO-6-2-9
Synonyms 2-Ethyl-7-nitro-5-(trifluoromethyl)-1H-benzimidazole 3-oxide 2-Ethyl-7-nitro-5-(trifluoromethyl)benzimidazole-3-oxide
Wiley ID 1278823