Dataset

p-Coumaraldehyde; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR308099 contains the MS2 mass spectrum of p-Coumaraldehyde with the InChIkey CJXMVKYNVIGQBS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H8O2/c10-7-1-2-8-3-5-9(11)6-4-8/h1-7,11H
SMILES OC1=CC=C(C=CC=O)C=C1
InChI Key CJXMVKYNVIGQBS-UHFFFAOYSA-N
Molecular Formula C9H8O2
Exact Mass 148.161 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-RIKEN-PR308099
Version
Author
Maintainer
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MetadataPublished 2019-03-28
Related Molecule
  • 3-(4-hydroxyphenyl)prop-2-enal
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    181650 ChEBI
    SCHEMBL197453 SureChEMBL
    440733 PubChem
    The data in this table is sourced from UniChem at EBI.