Dataset

N-Isopropyl-N-phenyl-p-phenylenediamine

This MassBank record with Accession MSBNK-UFZ-UF413703 contains the MS2 mass spectrum of N-Isopropyl-N-phenyl-p-phenylenediamine with the InChIkey OUBMGJOQLXMSNT-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H18N2/c1-12(2)16-14-8-10-15(11-9-14)17-13-6-4-3-5-7-13/h3-12,16-17H,1-2H3
SMILES CC(C)Nc1ccc(Nc2ccccc2)cc1
InChI Key OUBMGJOQLXMSNT-UHFFFAOYSA-N
Molecular Formula C15H18N2
Exact Mass 226.147 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF413703
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:01:39.105350
MetadataModified 2025-02-09T19:48:00.856568
MetadataPublished 2017-01-05
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1449018 ChEMBL
RAGSAV CCDC
ZINC000000393922 ZINC
DTXSID1025485 EPA CompTox Dashboard
J22.142B Nikkaji
DB14195 DrugBank
CB8475891 ChemicalBook
SCHEMBL38820 SureChEMBL
MCULE-4541283282 Mcule
20209262 NMRShiftDB
PD068078 ProbesDrugs
0M7PSL4100 FDA SRS
63569 ChEBI
101-72-4 ACToR
14916867 PubChem: Thomson Pharma
7573 PubChem
888649 eMolecules
The data in this table is sourced from UniChem at EBI.