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Alphamethrin
SpectraBase Compound ID 7h1PaEjQfq
InChI InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17-,18?,20-/m0/s1
InChIKey KAATUXNTWXVJKI-DXCJPMOASA-N
Mol Weight 416.3 g/mol
Molecular Formula C22H19Cl2NO3
Exact Mass 415.074199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPjP58qYnfD
Name Alphamethrin
CAS Registry Number 52315-07-8
Classification Pesticide
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 415.074198873 u
Formula C22H19Cl2NO3
InChI InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17-,18?,20-/m0/s1
InChIKey KAATUXNTWXVJKI-DXCJPMOASA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 416.304 g/mol
Nominal Mass 415 u
Quality 958
Retention Index 3015
SMILES C1([C@]([C@]1(C(OC(C=1C=C(OC=2C=CC=CC2)C=CC1)C#N)=O)[H])(C=C(Cl)Cl)[H])(C)C
SPLASH splash10-02ai-2900000000-d80b0edb67b0e9c206be
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Alfoxylate [Cyano-(3-phenoxyphenyl)methyl](1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-\rcarboxylate
Technique GC/MS
Wiley ID DD2024_011807