Dataset

4-Hydroxy-Benzotriazol

This MassBank record with Accession MSBNK-Athens_Univ-AU223601 contains the MS2 mass spectrum of 4-Hydroxy-Benzotriazol 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-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU223601
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:58:32.283700
MetadataModified 2025-02-08T19:01:13.683484
MetadataPublished 2015-12-05
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.