Triclocarban

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Systematic / IUPAC Name: 1-(4-Chlorophenyl)-3-(3,4-dichlorophenyl)urea

ID: Reference1174

Other Names: Cutisan;
Solubacter;
Trichlocarban;
Cusiter;
Genoface ; more

Formula: C13H9Cl3N2O

Class: Personal Care Products/Cosmetics

Spectral Data

Triclocarban 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; Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 4
No. of Spectra 295
Tandem Spectra MS1, MS2
Ionization Methods ESI; APCI
Analyzers FT
Last Modification 1/22/2015 1:14:15 PM
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Identificators

InChI InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)
InChI Key ICUTUKXCWQYESQ-UHFFFAOYSA-N
Canonical SMILES C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)Cl)Cl
CAS 101202
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Other Names Cutisan;
Solubacter;
Trichlocarban;
Cusiter;
Genoface;
Procutene;
TCC soap;
TCC;
3,4,4-Trichlorocarbanilide;
N-(4-Chlorophenyl)-N-(3,4-dichlorophenyl)-urea;
[(3,4-Dichlorophenyl)amino]-N-(4-chlorophenyl)carboxamide

In Other Databases

ChEMBL CHEMBL1076347
PubChem 7547
ChEBI CHEBI:48347
ChemSpider 7266
Wikipedia Triclocarban
ChemIDPlus 000101202
KEGG D06223