Dataset

N,N'-DI(PARA-CHLOROPHENYL)UREA

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004148 contains the MS mass spectrum of N,N'-DI(PARA-CHLOROPHENYL)UREA with the InChIkey ZNQCSLYENQIUMJ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C13H10Cl2N2O/c14-9-1-5-11(6-2-9)16-13(18)17-12-7-3-10(15)4-8-12/h1-8H,(H2,16,17,18)
SMILES O=C(Nc(c2)ccc(Cl)c2)Nc(c1)ccc(Cl)c1
InChI Key ZNQCSLYENQIUMJ-UHFFFAOYSA-N
Molecular Formula C13H10Cl2N2O
Exact Mass 280.017 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP004148
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:57:44.360485
MetadataModified 2024-01-11T15:57:44.518869
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
931631 eMolecules
142794 ChEBI
ZINC000000084701 ZINC
25728 BindingDB
CHEMBL3527390 ChEMBL
DTXSID70153436 EPA CompTox Dashboard
SCHEMBL4741253 SureChEMBL
94996 PubChem
16011655 PubChem: Thomson Pharma
1219-99-4 ACToR
51U4X0KQ6H FDA SRS
MIXZAV CCDC
J46.033H Nikkaji
MCULE-7859697534 Mcule
The data in this table is sourced from UniChem at EBI.