Dinitrocarbanilide

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Systematic / IUPAC Name: 1,3-Bis(4-nitrophenyl)urea

ID: Reference4911

Other Names: N,N'-Bis(p-nitrophenyl)urea ;
N,N'-Bis(4-nitrophenyl)urea ;
4,4'-Dinitrocarbanilide;
4',4''-Dinitrocarbanilide;
4,4'-Dinitrodiphenylurea ; more

Formula: C13H10N4O5

Class: Pesticides/Herbicides

Spectral Data

Dinitrocarbanilide 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 Orbitrap Fusion Lumos with ETD ; Q Exactive Orbitrap
No. of Spectral Trees 3
No. of Spectra 2156
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 5/30/2016 11:03:48 AM
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Identificators

InChI InChI=1S/C13H10N4O5/c18-13(14-9-1-5-11(6-2-9)16(19)20)15-10-3-7-12(8-4-10)17(21)22/h1-8H,(H2,14,15,18)
InChI Key JEZZOKXIXNSKQD-UHFFFAOYSA-N
Canonical SMILES
CAS 587906
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Other Names N,N'-Bis(p-nitrophenyl)urea ;
N,N'-Bis(4-nitrophenyl)urea ;
4,4'-Dinitrocarbanilide;
4',4''-Dinitrocarbanilide;
4,4'-Dinitrodiphenylurea;
Carbanilide, 4,4'-dinitro-;
Urea, N,N'-bis(4-nitrophenyl)- ;
Urea, 1,3-bis(p-nitrophenyl)-

In Other Databases

ChemSpider 9137
PubChem 9509
ChemIDPlus 000587906
ChEMBL CHEMBL1079395