Dataset

Acetone thiosemicarbazide; ESI-QTOF; MS2; CE: 10; [M+H]+

This MassBank record with Accession MSBNK-EPA-ENTACT_AGILENT000354 contains the MS2 mass spectrum of Acetone thiosemicarbazide with the InChIkey SVVFWWUVVASHTR-VOTSOKGWSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C4H9N3S/c1-3(2)6-7-4(5)8/h3H,1-2H3,(H2,5,8)/b7-6+
SMILES CC(C)/N=N/C(N)=S
InChI Key SVVFWWUVVASHTR-VOTSOKGWSA-N
Molecular Formula C4H9N3S
Exact Mass 131.052 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-EPA-ENTACT_AGILENT000354
Version
Author
Maintainer
Language
MetadataPublished 2023-05-02
Related Molecule
  • nfdi4chem-mol29020(Unknown Molecule)
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    146679149 pubchem
    The data in this table is sourced from UniChem at EBI.