Dataset

Nordazepam

This MassBank record with Accession MSBNK-Waters-WA000746 contains the MS mass spectrum of Nordazepam with the InChIkey AKPLHCDWDRPJGD-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H11ClN2O/c16-11-6-7-13-12(8-11)15(17-9-14(19)18-13)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)
SMILES O=C(C2)Nc(c3)c(cc(Cl)c3)C(=N2)c(c1)cccc1
InChI Key AKPLHCDWDRPJGD-UHFFFAOYSA-N
Molecular Formula C15H11ClN2O
Exact Mass 270.056 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000746
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:49:26.116852
MetadataModified 2024-01-11T22:49:26.259883
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
50027835 BindingDB
DOZKEI CCDC
J7.250H Nikkaji
NORDAZEPAM rxnorm
816 DrugCentral
C07486 KEGG Ligand
111762 ChEBI
CHEMBL523 ChEMBL
2997 PubChem
14819793 PubChem: Thomson Pharma
1088-11-5 ACToR
C07486 Recon
67220MCM01 FDA SRS
PD014374 ProbesDrugs
60021023 NMRShiftDB
MCULE-2705262252 Mcule
SCHEMBL78453 SureChEMBL
CB2292432 ChemicalBook
DB14028 DrugBank
HMDB0060538 Human Metabolome Database
MTBLC111762 Metabolights
ZINC000001249069 ZINC
DTXSID2049000 EPA CompTox Dashboard
524668 eMolecules
30326489 eMolecules
The data in this table is sourced from UniChem at EBI.