Dataset

Oxazepam

This MassBank record with Accession MSBNK-Eawag-EQ00274306 contains the MS2 mass spectrum of Oxazepam with the InChIkey ADIMAYPTOBDMTL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)
SMILES OC1N=C(C2=CC=CC=C2)C2=CC(Cl)=CC=C2NC1=O
InChI Key ADIMAYPTOBDMTL-UHFFFAOYSA-N
Molecular Formula C15H11ClN2O2
Exact Mass 286.051 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-EQ00274306
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T09:55:48.710470
MetadataModified 2025-02-09T09:55:48.931123
MetadataPublished 2024-06-14
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
35295-88-6 ACToR
PD009694 ProbesDrugs
14848993 PubChem: Thomson Pharma
PA450731 PharmGKB
SCHEMBL27435 SureChEMBL
4616 PubChem
604-75-1 ACToR
592985 eMolecules
HMDB0014980 Human Metabolome Database
oxazepam DailyMed
11744 Brenda
20182033 NMRShiftDB
J3.308A Nikkaji
SERAX clinicaltrials
85031 BindingDB
6GOW6DWN2A FDA SRS
DTXSID1021087 EPA CompTox Dashboard
OXAZEPAM DailyMed
7253 Guide to Pharmacology
OXAZEPAM rxnorm
2015 DrugCentral
OXAZEPAM clinicaltrials
CHEMBL568 ChEMBL
7823 ChEBI
C07359 KEGG Ligand
DB00842 DrugBank
The data in this table is sourced from UniChem at EBI.