Dataset

Sotalol; LC-ESI-Q; MS; POS; 90 V

This MassBank record with Accession MSBNK-Waters-WA000649 contains the MS mass spectrum of Sotalol with the InChIkey ZBMZVLHSJCTVON-UHFFFAOYSA-N.

Chemical Information

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)c(c1)ccc(c1)NS(C)(=O)=O
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-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000649
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide
    • 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.