Dataset

Desmethyl-Pirimicarb; LC-ESI-QFT; MS2; CE: 45%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01129603 contains the MS2 mass spectrum of Desmethyl-Pirimicarb with the InChIkey GTKRZJVAXAQBMB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H16N4O2/c1-6-7(2)12-9(11-3)13-8(6)16-10(15)14(4)5/h1-5H3,(H,11,12,13)
SMILES CC1=C(N=C(N=C1OC(=O)N(C)C)NC)C
InChI Key GTKRZJVAXAQBMB-UHFFFAOYSA-N
Molecular Formula C10H16N4O2
Exact Mass 224.127 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-EQ01129603
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MetadataPublished 2023-04-27
Related Molecule
  • [5,6-dimethyl-2-(methylamino)pyrimidin-4-yl] N,N-dimethylcarbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    30614-22-3 ACToR
    ZINC000006069079 ZINC
    SCHEMBL17602853 SureChEMBL
    J124.978I Nikkaji
    93139 PubChem
    The data in this table is sourced from UniChem at EBI.