Dataset

Prosulfocarb; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU257004 contains the MS2 mass spectrum of Prosulfocarb with the InChIkey NQLVQOSNDJXLKG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3
SMILES CCCN(CCC)C(=O)SCC1=CC=CC=C1
InChI Key NQLVQOSNDJXLKG-UHFFFAOYSA-N
Molecular Formula C14H21NOS
Exact Mass 251.134 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-Athens_Univ-AU257004
Version
Author
Maintainer
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MetadataPublished 2019-05-29
Related Molecule
  • S-benzyl N,N-dipropylcarbamothioate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:81941 chebi
    CHEMBL2251843 chembl
    20845 surechembl
    62020 pubchem
    8VCE6FU50D fdasrs
    260541 brenda
    Molport-027-836-893 molport
    The data in this table is sourced from UniChem at EBI.