Neburon

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Systematic / IUPAC Name: 1-Butyl-3-(3,4-dichlorophenyl)-1-methylurea

ID: Reference2521

Other Names: Kloben;
Granurex;
Neburea;
Neburex;
3-(3,4-Dichlorophenyl)-1-methyl-1-butylurea ; more

Formula: C12H16Cl2N2O

Class: Pesticides/Herbicides

Spectral Data

Neburon 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 HF Orbitrap
No. of Spectral Trees 1
No. of Spectra 65
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/25/2015 9:54:31 AM
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Identificators

InChI InChI=1S/C12H16Cl2N2O/c1-3-4-7-16(2)12(17)15-9-5-6-10(13)11(14)8-9/h5-6,8H,3-4,7H2,1-2H3,(H,15,17)
InChI Key CCGPUGMWYLICGL-UHFFFAOYSA-N
Canonical SMILES CCCCN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl
CAS 555373
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Other Names Kloben;
Granurex;
Neburea;
Neburex;
3-(3,4-Dichlorophenyl)-1-methyl-1-butylurea;
3-Butyl-1-(3,4-dichlorophenyl)-3-methylurea;
1-n-Butyl-3-(3,4-dichlorophenyl)-1-methylurea;
Urea, 1-butyl-3-(3,4-dichlorophenyl)-1-methyl-;
3-(3,4-Dichlorphenyl)-1-n-butyl-harnstoff;
3-(3,4-Dichlorophenyl)-1-methyl-1-n-butylurea

In Other Databases

KEGG C11188
ChemSpider 10672
PubChem 11145
ChemIDPlus 000555373
ChEMBL CHEMBL75410