Dataset

Salbutamol

This MassBank record with Accession MSBNK-Athens_Univ-AU110001 contains the MS2 mass spectrum of Salbutamol with the InChIkey NDAUXUAQIAJITI-UHFFFAOYSA-N.

Chemical Info

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 CC(C)(C)NCC(c1ccc(c(c1)CO)O)O
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-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU110001
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:41:57.477226
MetadataModified 2024-01-11T09:41:57.618583
MetadataPublished 2015-09-22
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
114657 Brenda
albuterol DailyMed
CB3129524 ChemicalBook
PA448068 PharmGKB
63162 Brenda
CB52675641 ChemicalBook
HMDB0001937 Human Metabolome Database
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
25769 BindingDB
CB84796992 ChemicalBook
ALBUTEROL DailyMed
ALBUTEROL SULFATE rxnorm
ACCUNEB rxnorm
VENTOLIN rxnorm
COMBIVENT rxnorm
ALBUTEROL rxnorm
PROVENTIL rxnorm
DUONEB rxnorm
SALBUTAMOL clinicaltrials
SALBUTAMOL SULFATE clinicaltrials
ALBUTEROL SULFATE clinicaltrials
VOSPIRE clinicaltrials
VOLMAX clinicaltrials
ACCUNEB clinicaltrials
2083 PubChem
PD001639 ProbesDrugs
BUVENTOL clinicaltrials
LSM-5178 LINCS
18559-94-9 ACToR
35763-26-9 ACToR
SCHEMBL4913 SureChEMBL
14749528 PubChem: Thomson Pharma
MCULE-4493408325 Mcule
J10.899E Nikkaji
CHEMBL714 ChEMBL
2549 ChEBI
558 Guide to Pharmacology
DB01001 DrugBank
26756445 eMolecules
511751 eMolecules
The data in this table is sourced from UniChem at EBI.