Dataset

4-DIMETHYLAMINOBENZOIC ACID; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010579 contains the MS mass spectrum of 4-DIMETHYLAMINOBENZOIC ACID with the InChIkey YDIYEOMDOWUDTJ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H11NO2/c1-10(2)8-5-3-7(4-6-8)9(11)12/h3-6H,1-2H3,(H,11,12)
SMILES CN(C)c(c1)ccc(c1)C(O)=O
InChI Key YDIYEOMDOWUDTJ-UHFFFAOYSA-N
Molecular Formula C9H11NO2
Exact Mass 165.079 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-Fac_Eng_Univ_Tokyo-JP010579
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 4-(dimethylamino)benzoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    MCULE-2235235718 Mcule
    20123964 NMRShiftDB
    CB4190291 ChemicalBook
    ZINC000000388582 ZINC
    106947 Brenda
    12092 PubChem
    PD004568 ProbesDrugs
    15120367 PubChem: Thomson Pharma
    619-84-1 ACToR
    SCHEMBL33368 SureChEMBL
    D1MA908EV0 FDA SRS
    493887 eMolecules
    DTXSID7060708 EPA CompTox Dashboard
    HMDB0246304 Human Metabolome Database
    PDABZA CCDC
    512661 BindingDB
    J26.944A Nikkaji
    CHEMBL112322 ChEMBL
    DB08748 DrugBank
    XP1 PDBe
    The data in this table is sourced from UniChem at EBI.