Dataset

Azobenzene

This MassBank record with Accession MSBNK-Athens_Univ-AU244006 contains the MS2 mass spectrum of Azobenzene with the InChIkey DMLAVOWQYNRWNQ-BUHFOSPRSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H/b14-13+
SMILES C1=CC=C(C=C1)\N=N\C1=CC=CC=C1
InChI Key DMLAVOWQYNRWNQ-BUHFOSPRSA-N
Molecular Formula C12H10N2
Exact Mass 182.084 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-Athens_Univ-AU244006
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:54:53.147892
MetadataModified 2025-02-08T19:08:47.535126
MetadataPublished 2019-04-08
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
F0U1H6UG5C FDA SRS
17082-12-1 ACToR
SCHEMBL32032 SureChEMBL
15487316 PubChem: Thomson Pharma
1080-16-6 ACToR
PD063912 ProbesDrugs
103-33-3 ACToR
477295 eMolecules
CB4383484 ChemicalBook
ZINC000003871618 ZINC
J4.020G Nikkaji
J37.408C Nikkaji
AZOBEN CCDC
HY-B2127 MedChemExpress
J37.407E Nikkaji
115180 BindingDB
CHEMBL58835 ChEMBL
C19334 KEGG Ligand
58996 ChEBI
The data in this table is sourced from UniChem at EBI.