Monodesmethylisoproturon

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Systematic / IUPAC Name: 1-Methyl-3-[4-(propan-2-yl)phenyl]urea

ID: Reference1061

Other Names: Urea, N-methyl-N'-[4-(1-methylethyl)phenyl]-;
1-(4-Isoprophenyl)-3-methylurea;
1-(4-Isopropylphenyl)-3-methylurea;
3-Methyl-1-[4-(propan-2-yl)phenyl]urea;
Demethylisoproturon

Formula: C11H16N2O

Class: Pesticides/Herbicides

Spectral Data

Monodesmethylisoproturon 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 LTQ Orbitrap XL
No. of Spectral Trees 1
No. of Spectra 68
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/11/2014 2:20:33 PM
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Identificators

InChI InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)
InChI Key DOULWWSSZVEPIN-UHFFFAOYSA-N
Canonical SMILES CC(C)C1=CC=C(C=C1)NC(=O)NC
CAS 34123574
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Other Names Urea, N-methyl-N'-[4-(1-methylethyl)phenyl]-;
1-(4-Isoprophenyl)-3-methylurea;
1-(4-Isopropylphenyl)-3-methylurea;
3-Methyl-1-[4-(propan-2-yl)phenyl]urea;
Demethylisoproturon

In Other Databases

ChemIDPlus 034123574
ChemSpider 158440
PubChem 182167
ChEMBL CHEMBL163921