Dataset

3,3`-Dimethylbenzidine

This MassBank record with Accession MSBNK-Athens_Univ-AU243402 contains the MS2 mass spectrum of 3,3`-Dimethylbenzidine with the InChIkey NUIURNJTPRWVAP-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C14H16N2/c1-9-7-11(3-5-13(9)15)12-4-6-14(16)10(2)8-12/h3-8H,15-16H2,1-2H3
SMILES	CC1=CC(=CC=C1N)C1=CC=C(N)C(C)=C1
InChI Key	NUIURNJTPRWVAP-UHFFFAOYSA-N
Molecular Formula	C14H16N2
Exact Mass	212.131 g/mol

Data and Resources

3,3`-DimethylbenzidineHTML
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Metadata Information

Field	Value
DOI
License URL
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU243402
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T09:50:15.920112
MetadataModified	2024-01-11T09:50:16.078457
MetadataPublished	2019-04-05

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
C14443	KEGG Ligand
CHEMBL85109	ChEMBL
510882	eMolecules
ZINC000000056751	ZINC
34320	ChEBI
DTXSID5024059	EPA CompTox Dashboard
34926	Brenda
63HLO2IV6K	FDA SRS
CB7852914	ChemicalBook
63254	Brenda
J1.189D	Nikkaji
HMDB0255871	Human Metabolome Database
DADMBP	CCDC
20097646	NMRShiftDB
MCULE-7764992616	Mcule
15171959	PubChem: Thomson Pharma
119-93-7	ACToR
SCHEMBL49414	SureChEMBL
8413	PubChem
The data in this table is sourced from UniChem at EBI.