Dataset

3,4,5-Trimethacarb; LC-ESI-QFT; MS2; CE: 15%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01132201 contains the MS2 mass spectrum of 3,4,5-Trimethacarb with the InChIkey AUQAUAIUNJIIEP-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H15NO2/c1-7-5-10(14-11(13)12-4)6-8(2)9(7)3/h5-6H,1-4H3,(H,12,13)
SMILES CC1=CC(=CC(=C1C)C)OC(=O)NC
InChI Key AUQAUAIUNJIIEP-UHFFFAOYSA-N
Molecular Formula C11H15NO2
Exact Mass 193.110 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-EQ01132201
Version
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Maintainer
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MetadataPublished 2023-04-27
Related Molecule
  • (3,4,5-trimethylphenyl) N-methylcarbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    17592 PubChem
    35870391 eMolecules
    CB3288766 ChemicalBook
    JG6XSN0Z2I FDA SRS
    38894 ChEBI
    12407-86-2 ACToR
    2686-99-9 ACToR
    SCHEMBL119743 SureChEMBL
    J7.646E Nikkaji
    DTXSID1040322 EPA CompTox Dashboard
    ZINC000002019888 ZINC
    The data in this table is sourced from UniChem at EBI.