Dataset

Sotalol

This MassBank record with Accession MSBNK-Athens_Univ-AU238301 contains the MS2 mass spectrum of Sotalol with the InChIkey ZBMZVLHSJCTVON-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3
SMILES CC(C)NCC(O)C1=CC=C(NS(C)(=O)=O)C=C1
InChI Key ZBMZVLHSJCTVON-UHFFFAOYSA-N
Molecular Formula C12H20N2O3S
Exact Mass 272.119 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU238301
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T08:51:36.052466
MetadataModified 2025-02-08T19:11:44.893124
MetadataPublished 2019-05-31
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL471 ChEMBL
C07309 KEGG Ligand
DB00489 DrugBank
SOTALOL DailyMed
25762 BindingDB
SOTYLIZE rxnorm
BETAPACE rxnorm
SORINE rxnorm
SOTALOL rxnorm
MJ 1999 clinicaltrials
BETAPACE clinicaltrials
SOTYLIZE clinicaltrials
SORINE clinicaltrials
SOTACOR clinicaltrials
SOTALEX clinicaltrials
SOTALOL clinicaltrials
SOTALOL HYDROCHLORIDE clinicaltrials
MJ-1999 clinicaltrials
A6D97U294I FDA SRS
DTXSID0023589 EPA CompTox Dashboard
2464 DrugCentral
7297 Guide to Pharmacology
J10.583J Nikkaji
SOTALOL HYDROCHLORIDE rxnorm
CB6277510 ChemicalBook
114658 Brenda
sotalol DailyMed
HMDB0014632 Human Metabolome Database
31227958 eMolecules
14775037 PubChem: Thomson Pharma
5253 PubChem
PD009998 ProbesDrugs
63622 ChEBI
PA451457 PharmGKB
27948-47-6 ACToR
3930-20-9 ACToR
SCHEMBL16407 SureChEMBL
LSM-1465 LINCS
The data in this table is sourced from UniChem at EBI.