Dataset

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

This MassBank record with Accession MSBNK-Waters-WA002642 contains the MS mass spectrum of Metribuzin with the InChIkey FOXFZRUHNHCZPX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3
SMILES CSC(=N1)N(N)C(=O)C(=N1)C(C)(C)C
InChI Key FOXFZRUHNHCZPX-UHFFFAOYSA-N
Molecular Formula C8H14N4OS
Exact Mass 214.089 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-WA002642
Version
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Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 4-amino-6-tert-butyl-3-methylsulfanyl-1,2,4-triazin-5-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CB6690573 ChemicalBook
    MCULE-7688611726 Mcule
    20206257 NMRShiftDB
    30479 PubChem
    21087-64-9 ACToR
    SCHEMBL66824 SureChEMBL
    14892211 PubChem: Thomson Pharma
    QO836138OV FDA SRS
    1299186 eMolecules
    J1.868F Nikkaji
    HY-116954 MedChemExpress
    VEYGEL CCDC
    HMDB0254685 Human Metabolome Database
    34846 ChEBI
    ZINC000000039744 ZINC
    DTXSID6024204 EPA CompTox Dashboard
    CHEMBL1902519 ChEMBL
    C14332 KEGG Ligand
    The data in this table is sourced from UniChem at EBI.