Dataset

Dimetilan; LC-ESI-QFT; MS2; CE: 120%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01123107 contains the MS2 mass spectrum of Dimetilan with the InChIkey RDBIYWSVMRVKSG-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H16N4O3/c1-7-6-8(17-10(16)13(4)5)11-14(7)9(15)12(2)3/h6H,1-5H3
SMILES CC1=CC(=NN1C(=O)N(C)C)OC(=O)N(C)C
InChI Key RDBIYWSVMRVKSG-UHFFFAOYSA-N
Molecular Formula C10H16N4O3
Exact Mass 240.122 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-EQ01123107
Version
Author
Maintainer
Language
MetadataPublished 2023-04-27
Related Molecule
  • [1-(dimethylcarbamoyl)-5-methylpyrazol-3-yl] N,N-dimethylcarbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:233357 chebi
    CHEMBL3183014 chembl
    118922 surechembl
    12572 pubchem
    S53KQ82I35 fdasrs
    The data in this table is sourced from UniChem at EBI.