Dataset

Dimethenamid; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU339103 contains the MS2 mass spectrum of Dimethenamid with the InChIkey JLYFCTQDENRSOL-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3
SMILES COCC(C)N(C(=O)CCl)C1=C(C)SC=C1C
InChI Key JLYFCTQDENRSOL-UHFFFAOYSA-N
Molecular Formula C12H18ClNO2S
Exact Mass 275.075 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-Athens_Univ-AU339103
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MetadataPublished 2015-12-09
Related Molecule
  • 2-chloro-N-(2,4-dimethylthiophen-3-yl)-N-(1-methoxypropan-2-yl)acetamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:83638 chebi
    CHEMBL1565335 chembl
    53864 surechembl
    91744 pubchem
    8504Z6C4XZ fdasrs
    HMDB0251377 hmdb
    The data in this table is sourced from UniChem at EBI.