Dataset

Propafenone

This MassBank record with Accession MSBNK-Waters-WA000688 contains the MS mass spectrum of Propafenone with the InChIkey JWHAUXFOSRPERK-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C21H27NO3/c1-2-14-22-15-18(23)16-25-21-11-7-6-10-19(21)20(24)13-12-17-8-4-3-5-9-17/h3-11,18,22-23H,2,12-16H2,1H3
SMILES CCCNCC(O)COc(c2)c(ccc2)C(=O)CCc(c1)cccc1
InChI Key JWHAUXFOSRPERK-UHFFFAOYSA-N
Molecular Formula C21H27NO3
Exact Mass 341.199 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-WA000688
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:46:17.914613
MetadataModified 2024-01-11T22:46:18.143718
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL631 ChEMBL
SAM002564228 NIH Clinical Collection
C07381 KEGG Ligand
DB01182 DrugBank
593585 eMolecules
14900354 PubChem: Thomson Pharma
4932 PubChem
PD002872 ProbesDrugs
63619 ChEBI
Propafenone(Rytmonorm) Selleck
SCHEMBL27865 SureChEMBL
107300-59-4 ACToR
54063-53-5 ACToR
LSM-1416 LINCS
MCULE-8776872379 Mcule
2291 DrugCentral
68IQX3T69U FDA SRS
DTXSID9045184 EPA CompTox Dashboard
SCHEMBL16730120 SureChEMBL
PROPAFENONE HYDROCHLORIDE clinicaltrials
RYTHMOL SR clinicaltrials
RYTHMOL clinicaltrials
PROPAFENONE clinicaltrials
PROPAFENON HEXAL clinicaltrials
RYTHMOL rxnorm
PROPAFENONE HYDROCHLORIDE rxnorm
PROPAFENONE rxnorm
PROPAFENONE DailyMed
229819 Brenda
229818 Brenda
50067133 BindingDB
2561 Guide to Pharmacology
CB2854418 ChemicalBook
CB2183169 ChemicalBook
propafenone DailyMed
HMDB0015313 Human Metabolome Database
122954 Brenda
PA451131 PharmGKB
J12.333A Nikkaji
The data in this table is sourced from UniChem at EBI.