Dataset

4-METHOXYBENZYLAMINE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP011883 contains the MS mass spectrum of 4-METHOXYBENZYLAMINE with the InChIkey IDPURXSQCKYKIJ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H11NO/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,6,9H2,1H3
SMILES NCc(c1)ccc(OC)c1
InChI Key IDPURXSQCKYKIJ-UHFFFAOYSA-N
Molecular Formula C8H11NO
Exact Mass 137.084 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-JP011883
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • (4-methoxyphenyl)methanamine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    PZM PDBe
    CHEMBL12720 ChEMBL
    DTXSID2062371 EPA CompTox Dashboard
    50408784 BindingDB
    J101.237A Nikkaji
    ZINC000000157596 ZINC
    49837 ChEBI
    15120013 PubChem: Thomson Pharma
    SCHEMBL8755 SureChEMBL
    2393-23-9 ACToR
    526905 eMolecules
    20032298 NMRShiftDB
    75452 PubChem
    MCULE-1657332685 Mcule
    CB8326324 ChemicalBook
    62257 Brenda
    15412 Brenda
    The data in this table is sourced from UniChem at EBI.