Dataset

2-Ethyl-6-methylaniline; LC-ESI-QTOF; MS2; 130 V

This MassBank record with Accession MSBNK-BAFG-CSL23111010283 contains the MS2 mass spectrum of 2-Ethyl-6-methylaniline with the InChIkey JJVKJJNCIILLRP-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H13N/c1-3-8-6-4-5-7(2)9(8)10/h4-6H,3,10H2,1-2H3
SMILES CCC1=CC=CC(=C1N)C
InChI Key JJVKJJNCIILLRP-UHFFFAOYSA-N
Molecular Formula C9H13N
Exact Mass 135.105 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL23111010283
Version
Author
Maintainer
Language
MetadataPublished 2023-11-10
Related Molecule
  • 2-ethyl-6-methylaniline
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    32485 PubChem
    20040383 NMRShiftDB
    MCULE-5418966969 Mcule
    CHEMBL3187754 ChEMBL
    SCHEMBL755515 SureChEMBL
    ZINC000002014545 ZINC
    J3.796F Nikkaji
    DTXSID7027833 EPA CompTox Dashboard
    475901 eMolecules
    15898304 PubChem: Thomson Pharma
    32Y3271G51 FDA SRS
    24549-06-2 ACToR
    CB9346226 ChemicalBook
    The data in this table is sourced from UniChem at EBI.