Dataset

2,6-Dimethylaniline; LC-ESI-QQ; MS2; CE:20 V; [M+H]+

This MassBank record with Accession MSBNK-Keio_Univ-KO002802 contains the MS2 mass spectrum of 2,6-Dimethylaniline with the InChIkey UFFBMTHBGFGIHF-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3
SMILES Cc(c1)c(N)c(C)cc1
InChI Key UFFBMTHBGFGIHF-UHFFFAOYSA-N
Molecular Formula C8H11N
Exact Mass 121.089 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Keio_Univ-KO002802
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 2,6-dimethylaniline
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:28738 chebi
    CHEMBL1340793 chembl
    106244 surechembl
    6896 pubchem
    4FT62OX08D fdasrs
    PD065540 probes_and_drugs
    CVMAMA CCDC
    207265 brenda
    233356 brenda
    233357 brenda
    HMDB0060677 hmdb
    Molport-000-871-481 molport
    The data in this table is sourced from UniChem at EBI.