Dataset

Mexiletine

This MassBank record with Accession MSBNK-Waters-WA002979 contains the MS mass spectrum of Mexiletine with the InChIkey VLPIATFUUWWMKC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3
SMILES CC(N)COc(c(C)1)c(C)ccc1
InChI Key VLPIATFUUWWMKC-UHFFFAOYSA-N
Molecular Formula C11H17NO
Exact Mass 179.131 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-WA002979
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:34:22.134366
MetadataModified 2025-02-09T20:22:04.274962
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
4178 PubChem
PD010214 ProbesDrugs
mexiletine Atlas
14772717 PubChem: Thomson Pharma
31828-71-4 ACToR
LSM-1700 LINCS
1012300 eMolecules
MCULE-1930292316 Mcule
6916 ChEBI
SCHEMBL16081 SureChEMBL
mexiletine DailyMed
CB22750077 ChemicalBook
122768 Brenda
HMDB0014523 Human Metabolome Database
J19.958C Nikkaji
1794 DrugCentral
DTXSID8048446 EPA CompTox Dashboard
1U511HHV4Z FDA SRS
KO-1173 clinicaltrials
MEXILETINE HYDROCHLORIDE clinicaltrials
MEXILETINE clinicaltrials
MEXITIL clinicaltrials
MEXILETINE rxnorm
50117271 BindingDB
MEXILETINE DailyMed
MEXILETINE HYDROCHLORIDE rxnorm
PA450488 PharmGKB
CB9497353 ChemicalBook
CHEMBL558 ChEMBL
C07220 KEGG Ligand
DB00379 DrugBank
2629 Guide to Pharmacology
The data in this table is sourced from UniChem at EBI.