Dataset

Metformin; LC-ESI-ITFT; MS2; CE: 80; R=15000; [M+H]+

This MassBank record with Accession MSBNK-UFZ-UF412402 contains the MS2 mass spectrum of Metformin with the InChIkey XZWYZXLIPXDOLR-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C4H11N5/c1-9(2)4(7)8-3(5)6/h1-2H3,(H5,5,6,7,8)
SMILES CN(C)C(=N)NC(N)=N
InChI Key XZWYZXLIPXDOLR-UHFFFAOYSA-N
Molecular Formula C4H11N5
Exact Mass 129.101 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-UFZ-UF412402
Version
Author
Maintainer
Language
MetadataPublished 2017-01-05
Related Molecule
  • 3-(diaminomethylidene)-1,1-dimethylguanidine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    4091 PubChem
    PD010095 ProbesDrugs
    CB22706988 ChemicalBook
    9100L32L2N FDA SRS
    LSM-4730 LINCS
    657-24-9 ACToR
    metformin Atlas
    26219491 eMolecules
    10320221 eMolecules
    661910 eMolecules
    metformin DailyMed
    PA450395 PharmGKB
    CB0506294 ChemicalBook
    ZINC000012859773 ZINC
    HMDB0001921 Human Metabolome Database
    MF8 PDBe
    MCULE-7393156510 Mcule
    SCHEMBL8944 SureChEMBL
    CHEMBL1431 ChEMBL
    6801 ChEBI
    C07151 KEGG Ligand
    DB00331 DrugBank
    15297229 PubChem: Thomson Pharma
    1725 DrugCentral
    57047 BindingDB
    GLUCOPHAGE rxnorm
    GLUMETZA rxnorm
    RIOMET rxnorm
    METFORMIN HYDROCHLORIDE rxnorm
    FORTAMET rxnorm
    METFORMIN rxnorm
    JANUMET rxnorm
    METFORMIN clinicaltrials
    METFORMIN HYDROCHLORIDE clinicaltrials
    GLUCOPHAGE clinicaltrials
    GLUCOPHAGE XR clinicaltrials
    GLUMETZA clinicaltrials
    DIABEX clinicaltrials
    FORTAMET clinicaltrials
    RIOMET clinicaltrials
    HY-B0627 MedChemExpress
    155906370 PubChem
    DTXSID2023270 EPA CompTox Dashboard
    4779 Guide to Pharmacology
    4503 Guide to Pharmacology
    J9.463C Nikkaji
    UVIGAK CCDC
    152743144 PubChem
    50229665 BindingDB
    METFORMIN DailyMed
    The data in this table is sourced from UniChem at EBI.