Dataset

1,3-Dimethyl-2-imidazolidinon; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU223101 contains the MS2 mass spectrum of 1,3-Dimethyl-2-imidazolidinon with the InChIkey CYSGHNMQYZDMIA-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C5H10N2O/c1-6-3-4-7(2)5(6)8/h3-4H2,1-2H3
SMILES CN1CCN(C1=O)C
InChI Key CYSGHNMQYZDMIA-UHFFFAOYSA-N
Molecular Formula C5H10N2O
Exact Mass 114.079 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-AU223101
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Maintainer
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MetadataPublished 2016-02-22
Related Molecule
  • 1,3-dimethylimidazolidin-2-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    487202 eMolecules
    6661 PubChem
    193015 ChEBI
    15194356 PubChem: Thomson Pharma
    SCHEMBL3043 SureChEMBL
    80-73-9 ACToR
    5C1YQQ9M90 FDA SRS
    10008856 NMRShiftDB
    MCULE-4012400107 Mcule
    CB3332975 ChemicalBook
    J11.846J Nikkaji
    ZINC000000164649 ZINC
    DTXSID1073153 EPA CompTox Dashboard
    DAGGAU CCDC
    CHEMBL12338 ChEMBL
    The data in this table is sourced from UniChem at EBI.