Dataset

Fuberidazole

This MassBank record with Accession MSBNK-Eawag-EQ00352554 contains the MS2 mass spectrum of Fuberidazole with the InChIkey UYJUZNLFJAWNEZ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H8N2O/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10/h1-7H,(H,12,13)
SMILES C1=CC=C2C(=C1)NC(=N2)C3=CC=CO3
InChI Key UYJUZNLFJAWNEZ-UHFFFAOYSA-N
Molecular Formula C11H8N2O
Exact Mass 184.064 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ00352554
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T09:55:34.885391
MetadataModified 2025-02-09T09:55:35.051040
MetadataPublished 2024-06-14
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C18737 KEGG Ligand
CHEMBL201094 ChEMBL
50180740 BindingDB
J2.201B Nikkaji
ZINC000000040234 ZINC
DTXSID4041995 EPA CompTox Dashboard
CB4345158 ChemicalBook
RXD450F6C7 FDA SRS
3878-19-1 ACToR
15322139 PubChem: Thomson Pharma
81926 ChEBI
SCHEMBL23174 SureChEMBL
509917 eMolecules
MCULE-1895628564 Mcule
19756 PubChem
87364 Brenda
The data in this table is sourced from UniChem at EBI.