Dataset

4-Hydroxybenzotriazole

This MassBank record with Accession MSBNK-UFZ-UF420102 contains the MS2 mass spectrum of 4-Hydroxybenzotriazole with the InChIkey JMTMSDXUXJISAY-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C6H5N3O/c10-5-3-1-2-4-6(5)8-9-7-4/h1-3,10H,(H,7,8,9)
SMILES C1=CC2=NNN=C2C(=C1)O
InChI Key JMTMSDXUXJISAY-UHFFFAOYSA-N
Molecular Formula C6H5N3O
Exact Mass 135.043 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-UF420102
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:53:19.763920
MetadataModified 2025-02-09T19:47:58.777990
MetadataPublished 2017-01-05
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
5759096 eMolecules
525301 eMolecules
56393346 PubChem: Thomson Pharma
14747712 PubChem: Thomson Pharma
SCHEMBL18306 SureChEMBL
PD148428 ProbesDrugs
DTXSID90374722 EPA CompTox Dashboard
CB2760065 ChemicalBook
135399369 PubChem
J3.401.599F Nikkaji
ZINC000002571481 ZINC
The data in this table is sourced from UniChem at EBI.