Dataset

2-PROPANOL; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP000271 contains the MS mass spectrum of 2-PROPANOL with the InChIkey KFZMGEQAYNKOFK-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
SMILES CC(C)O
InChI Key KFZMGEQAYNKOFK-UHFFFAOYSA-N
Molecular Formula C3H8O
Exact Mass 60.058 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP000271
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • propan-2-ol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    ISOPROPYL ALCOHOL DailyMed
    ISOPROPYL ALCOHOL rxnorm
    2-PROPANOL clinicaltrials
    ISOPROPYL ALCOHOL clinicaltrials
    ISOPROPANOL clinicaltrials
    J1.411G Nikkaji
    DTXSID7020762 EPA CompTox Dashboard
    4215 DrugCentral
    ZINC000000901159 ZINC
    CB7300596 ChemicalBook
    ZURAGARD clinicaltrials
    682 Brenda
    17824 ChEBI
    IPA PDBe
    C01845 KEGG Ligand
    DB02325 DrugBank
    CHEMBL582 ChEMBL
    18169 Brenda
    49534 Brenda
    CB8854102 ChemicalBook
    isopropyl alcohol DailyMed
    17824 Rhea
    HMDB0000863 Human Metabolome Database
    1878 Brenda
    20752 Brenda
    80355 Brenda
    30754 Brenda
    958 Brenda
    MCULE-6646752234 Mcule
    SCHEMBL385 SureChEMBL
    10016625 NMRShiftDB
    3776 PubChem
    PD009429 ProbesDrugs
    ND2M416302 FDA SRS
    67-63-0 ACToR
    15194127 PubChem: Thomson Pharma
    5131-95-3 ACToR
    PA450117 PharmGKB
    8003-15-4 ACToR
    478530 eMolecules
    The data in this table is sourced from UniChem at EBI.