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Prodiamine
SpectraBase Compound ID CNj1naFzn0q
InChI InChI=1S/C13H17F3N4O4/c1-3-5-18(6-4-2)11-9(19(21)22)7-8(13(14,15)16)10(17)12(11)20(23)24/h7H,3-6,17H2,1-2H3
InChIKey RSVPPPHXAASNOL-UHFFFAOYSA-N
Mol Weight 350.3 g/mol
Molecular Formula C13H17F3N4O4
Exact Mass 350.12019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bdp5IBXLDWL
Name Prodiamine
Source of Sample Sigma-Aldrich Cat. #46454
CAS Registry Number 29091-21-2
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 350.120189528 u
Formula C13H17F3N4O4
InChI InChI=1S/C13H17F3N4O4/c1-3-5-18(6-4-2)11-9(19(21)22)7-8(13(14,15)16)10(17)12(11)20(23)24/h7H,3-6,17H2,1-2H3
InChIKey RSVPPPHXAASNOL-UHFFFAOYSA-N
Molecular Weight 350.298 g/mol
Number of Peaks 278
RI1 1949
SMILES Nc1c(cc(c(c1N(=O)=O)N(CCC)CCC)N(=O)=O)C(F)(F)F
SPLASH splash10-0096-5693000000-bdbc8aed4fd13e0ffd36
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 1,3-Benzenediamine, 2,6-dinitro-N1,N1-dipropyl-4-(trifluoromethyl)-
Wiley ID LM_PEST_866