Dataset

Salbutamol; LC-ESI-Q; MS; POS; 75 V

This MassBank record with Accession MSBNK-Waters-WA000681 contains the MS mass spectrum of Salbutamol with the InChIkey NDAUXUAQIAJITI-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3
SMILES OCc(c1)c(O)ccc1C(O)CNC(C)(C)C
InChI Key NDAUXUAQIAJITI-UHFFFAOYSA-N
Molecular Formula C13H21NO3
Exact Mass 239.152 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-WA000681
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CB52675641 ChemicalBook
    CB84796992 ChemicalBook
    25769 BindingDB
    DUONEB rxnorm
    ALBUTEROL SULFATE rxnorm
    ACCUNEB rxnorm
    VENTOLIN rxnorm
    COMBIVENT rxnorm
    ALBUTEROL rxnorm
    PROVENTIL rxnorm
    SALBUTAMOL clinicaltrials
    SALBUTAMOL SULFATE clinicaltrials
    ALBUTEROL SULFATE clinicaltrials
    VOSPIRE clinicaltrials
    VOLMAX clinicaltrials
    ACCUNEB clinicaltrials
    VENTILASTIN clinicaltrials
    VENTODISKS clinicaltrials
    VENTOLIN clinicaltrials
    PROVENTIL clinicaltrials
    AEROLIN clinicaltrials
    PROAIR clinicaltrials
    PROAIR RESPICLICK clinicaltrials
    AIROMIR clinicaltrials
    ALBUTEROL clinicaltrials
    SULTANOL clinicaltrials
    HY-B1037 MedChemExpress
    QF8SVZ843E FDA SRS
    DTXSID5021255 EPA CompTox Dashboard
    105 DrugCentral
    J10.899E Nikkaji
    ALBUTEROL DailyMed
    CHEMBL714 ChEMBL
    2549 ChEBI
    DB01001 DrugBank
    558 Guide to Pharmacology
    CB3129524 ChemicalBook
    albuterol DailyMed
    63162 Brenda
    114657 Brenda
    PA448068 PharmGKB
    HMDB0001937 Human Metabolome Database
    MCULE-4493408325 Mcule
    2083 PubChem
    PD001639 ProbesDrugs
    BUVENTOL clinicaltrials
    LSM-5178 LINCS
    18559-94-9 ACToR
    35763-26-9 ACToR
    SCHEMBL4913 SureChEMBL
    14749528 PubChem: Thomson Pharma
    26756445 eMolecules
    511751 eMolecules
    The data in this table is sourced from UniChem at EBI.