Dataset

4`-Aminoacetanilide; LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+

This MassBank record with Accession MSBNK-UFZ-UF413504 contains the MS2 mass spectrum of 4`-Aminoacetanilide with the InChIkey CHMBIJAOCISYEW-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H10N2O/c1-6(11)10-8-4-2-7(9)3-5-8/h2-5H,9H2,1H3,(H,10,11)
SMILES CC(=O)NC1=CC=C(N)C=C1
InChI Key CHMBIJAOCISYEW-UHFFFAOYSA-N
Molecular Formula C8H10N2O
Exact Mass 150.079 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF413504
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Maintainer
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MetadataPublished 2017-01-05
Related Molecule
  • N-(4-aminophenyl)acetamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    476377 eMolecules
    IH5OX0I3Z9 FDA SRS
    122-80-5 ACToR
    31230 PubChem
    16081029 PubChem: Thomson Pharma
    SCHEMBL92049 SureChEMBL
    CB8776835 ChemicalBook
    109532 Brenda
    69587 Brenda
    MCULE-8040281733 Mcule
    89617 NMRShiftDB
    DTXSID7024455 EPA CompTox Dashboard
    ZINC000000152946 ZINC
    PACTAN CCDC
    J43.352G Nikkaji
    CHEMBL1318876 ChEMBL
    The data in this table is sourced from UniChem at EBI.