Dataset

Primidone

This MassBank record with Accession MSBNK-Waters-WA000657 contains the MS mass spectrum of Primidone with the InChIkey DQMZLTXERSFNPB-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)
SMILES CCC(C(=O)2)(C(=O)NCN2)c(c1)cccc1
InChI Key DQMZLTXERSFNPB-UHFFFAOYSA-N
Molecular Formula C12H14N2O2
Exact Mass 218.106 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-WA000657
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:50:50.641125
MetadataModified 2024-01-11T22:50:50.803779
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL856 ChEMBL
SAM002554925 NIH Clinical Collection
C07371 KEGG Ligand
DB00794 DrugBank
593774 eMolecules
8412 ChEBI
MCULE-2519004832 Mcule
5338 Guide to Pharmacology
J3.260C Nikkaji
EPHPMO CCDC
4909 PubChem
PD001787 ProbesDrugs
13AFD7670Q FDA SRS
LSM-2700 LINCS
15121366 PubChem: Thomson Pharma
PA451105 PharmGKB
SCHEMBL34221 SureChEMBL
Primidone(Mysoline) Selleck
125-33-7 ACToR
2267 DrugCentral
ZINC000000001979 ZINC
PRIMIDONE DailyMed
PRIMIDONE rxnorm
DTXSID7023510 EPA CompTox Dashboard
50248152 BindingDB
MYSOLINE clinicaltrials
PRIMIDONE clinicaltrials
HY-B0339 MedChemExpress
MYSOLINE rxnorm
HMDB0014932 Human Metabolome Database
primidone DailyMed
33787 Brenda
CB1161900 ChemicalBook
The data in this table is sourced from UniChem at EBI.