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Cyhalothrin isomer II
SpectraBase Compound ID 2l9tKXRdEIH
InChI InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18?,20-/m1/s1
InChIKey ZXQYGBMAQZUVMI-BWHPXCRDSA-N
Mol Weight 449.86 g/mol
Molecular Formula C23H19ClF3NO3
Exact Mass 449.100556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRbZKmw94If
Name Cyhalothrin isomer I
Source of Sample Sigma-Aldrich Cat. #36996
CAS Registry Number 68085-85-8
Classification Pesticides: Acaricides
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Formula C23H19ClF3NO3
InChI InChI=1S/C23H19ClF3NO3/c1-22(2)17(12-19(24)23(25,26)27)20(22)21(29)31-18(13-28)14-7-6-10-16(11-14)30-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/b19-12-/t17-,18?,20-/m1/s1
InChIKey ZXQYGBMAQZUVMI-BWHPXCRDSA-N
Number of Peaks 50
RI1 2569
SMILES [C@]1(\C=C\(Cl)C(F)(F)F)(C(C)(C)[C@]1(C(=O)OC(C#N)c1cc(Oc2ccccc2)ccc1)[H])[H]
SPLASH splash10-053s-2920000000-5796a8ba22029bc80439
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Cyclopropanecarboxylic acid, 3-(2-chloro-3,3,3-trifluoro-1-propen-1-yl)-2,2-dimethyl-, cyano(3-phenoxyphenyl)methyl ester
Wiley ID LM_PEST_251