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Fluchloralin
SpectraBase Compound ID BzfQcdkNaoq
InChI InChI=1S/C12H13ClF3N3O4/c1-2-4-17(5-3-13)11-9(18(20)21)6-8(12(14,15)16)7-10(11)19(22)23/h6-7H,2-5H2,1H3
InChIKey MNFMIVVPXOGUMX-UHFFFAOYSA-N
Mol Weight 355.7 g/mol
Molecular Formula C12H13ClF3N3O4
Exact Mass 355.054668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqgLv3arwNO
Name Fluchloralin
Source of Sample Sigma-Aldrich Cat. #45500
CAS Registry Number 33245-39-5
Classification Pesticides: Herbicides
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 355.054668096 u
Formula C12H13ClF3N3O4
InChI InChI=1S/C12H13ClF3N3O4/c1-2-4-17(5-3-13)11-9(18(20)21)6-8(12(14,15)16)7-10(11)19(22)23/h6-7H,2-5H2,1H3
InChIKey MNFMIVVPXOGUMX-UHFFFAOYSA-N
Molecular Weight 355.701 g/mol
Number of Peaks 301
RI1 1796
SMILES c1(cc(c(c(c1)N(=O)=O)N(CCCl)CCC)N(=O)=O)C(F)(F)F
SPLASH splash10-03fu-9646000000-d52db291567df73f00eb
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzenamine, N-(2-chloroethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)-
Wiley ID LM_PEST_544