Dataset

Dazomet; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ00015303 contains the MS2 mass spectrum of Dazomet with the InChIkey QAYICIQNSGETAS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C5H10N2S2/c1-6-3-7(2)5(8)9-4-6/h3-4H2,1-2H3
SMILES CN1CN(C(=S)SC1)C
InChI Key QAYICIQNSGETAS-UHFFFAOYSA-N
Molecular Formula C5H10N2S2
Exact Mass 162.029 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-Eawag-EQ00015303
Version
Author
Maintainer
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MetadataPublished 2024-06-14
Related Molecule
  • 3,5-dimethyl-1,3,5-thiadiazinane-2-thione
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:75212 chebi
    CHEMBL1407826 chembl
    21382 surechembl
    10788 pubchem
    S7419CG4W5 fdasrs
    PD016061 probes_and_drugs
    HMDB0250885 hmdb
    Molport-001-832-799 molport
    The data in this table is sourced from UniChem at EBI.