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Flumetralin
SpectraBase Compound ID 6JFR18u6Ox
InChI InChI=1S/C16H12ClF4N3O4/c1-2-22(8-10-11(17)4-3-5-12(10)18)15-13(23(25)26)6-9(16(19,20)21)7-14(15)24(27)28/h3-7H,2,8H2,1H3
InChIKey PWNAWOCHVWERAR-UHFFFAOYSA-N
Mol Weight 421.74 g/mol
Molecular Formula C16H12ClF4N3O4
Exact Mass 421.045246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6RyaDqEvtXU
Name FLUMETRALINE
CAS Registry Number 62924-70-3
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 421.045246226 u
Formula C16H12ClF4N3O4
InChI InChI=1S/C16H12ClF4N3O4/c1-2-22(8-10-11(17)4-3-5-12(10)18)15-13(23(25)26)6-9(16(19,20)21)7-14(15)24(27)28/h3-7H,2,8H2,1H3
InChIKey PWNAWOCHVWERAR-UHFFFAOYSA-N
Molecular Weight 421.736 g/mol
Nominal Mass 421 u
Number of Peaks 144
SMILES CCN(Cc1c(cccc1Cl)F)c1c(cc(cc1[N+]([O-])=O)C(F)(F)F)[N+]([O-])=O
SPLASH splash10-0006-0931100000-c813734f35a37017a83a
Source of Spectrum Dr. Rolf Kuehnle
Synonyms N-(2-chloro-6-fluorobenzyl)-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-ethylamine N-(2-chloro-6-fluorobenzyl)-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline
Technique GC/MS
Wiley ID WID_MSPA_4303