Monalide

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Systematic / IUPAC Name: N-(4-Chlorophenyl)-2,2-dimethylpentanamide

ID: Reference1656

Other Names: Potablan;
Pentanamide, N-(4-chlorophenyl)-2,2-dimethyl-;
N-(4-Chlorophenyl)-2,2-dimethylvaleroamide;
N-(4-Chlorphenyl)-2,2-dimethylpentamid;
N-(4-Chlorophenyl)-2,2-dimethylvaleramide

Formula: C13H18ClNO

Class: Pesticides/Herbicides

Spectral Data

Monalide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 86
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/6/2015 3:37:45 PM
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Identificators

InChI InChI=1S/C13H18ClNO/c1-4-9-13(2,3)12(16)15-11-7-5-10(14)6-8-11/h5-8H,4,9H2,1-3H3,(H,15,16)
InChI Key KXGYBSNVFXBPNO-UHFFFAOYSA-N
Canonical SMILES CCCC(C)(C)C(=O)NC1=CC=C(C=C1)Cl
CAS 7287367
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Other Names Potablan;
Pentanamide, N-(4-chlorophenyl)-2,2-dimethyl-;
N-(4-Chlorophenyl)-2,2-dimethylvaleroamide;
N-(4-Chlorphenyl)-2,2-dimethylpentamid;
N-(4-Chlorophenyl)-2,2-dimethylvaleramide

In Other Databases

ChEMBL CHEMBL1520034
ChemSpider 22175
PubChem 23715
KEGG C19053
ChemIDPlus 007287367