Dataset

1-Cyclohexyl-3-(2-methylphenyl)urea; LC-ESI-QTOF; MS2; 50 V

This MassBank record with Accession MSBNK-BAFG-CSL23111015633 contains the MS2 mass spectrum of 1-Cyclohexyl-3-(2-methylphenyl)urea with the InChIkey JYBQTDHFCBQLHP-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C14H20N2O/c1-11-7-5-6-10-13(11)16-14(17)15-12-8-3-2-4-9-12/h5-7,10,12H,2-4,8-9H2,1H3,(H2,15,16,17)
SMILES O=C(NC1CCCCC1)Nc2ccccc2C
InChI Key JYBQTDHFCBQLHP-UHFFFAOYSA-N
Molecular Formula C14H20N2O
Exact Mass 232.158 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL23111015633
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MetadataPublished 2023-11-10
Related Molecule
  • 1-cyclohexyl-3-(2-methylphenyl)urea
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    MCULE-8651614999 Mcule
    3509937 PubChem
    1105921 eMolecules
    SCHEMBL813710 SureChEMBL
    ZINC000000396593 ZINC
    The data in this table is sourced from UniChem at EBI.