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Coumachlor ME
SpectraBase Compound ID FpmhcuicGJI
InChI InChI=1S/C20H17ClO4/c1-12(22)11-16(13-7-9-14(21)10-8-13)18-19(24-2)15-5-3-4-6-17(15)25-20(18)23/h3-10,16H,11H2,1-2H3
InChIKey CBGNTUSYXDOUAM-UHFFFAOYSA-N
Mol Weight 356.81 g/mol
Molecular Formula C20H17ClO4
Exact Mass 356.081537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYgUKX5FeRX
Name Coumachlor ME
Classification Anticoagulant Rodenticide
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Exact Mass 356.081536723 u
Formula C20H17ClO4
InChI InChI=1S/C20H17ClO4/c1-12(22)11-16(13-7-9-14(21)10-8-13)18-19(24-2)15-5-3-4-6-17(15)25-20(18)23/h3-10,16H,11H2,1-2H3
InChIKey CBGNTUSYXDOUAM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 356.805 g/mol
SMILES C1(=C(c2ccccc2OC1=O)OC)C(c1ccc(cc1)Cl)CC(=O)C
SPLASH splash10-03di-2629000000-5205590ef717ac71f104
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: UME UGLUCME
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_4143