Dataset

trans-Cinnamic acid; LC-ESI-QTOF; MS2

This MassBank record with Accession MSBNK-RIKEN-PR307042 contains the MS2 mass spectrum of trans-Cinnamic acid with the InChIkey WBYWAXJHAXSJNI-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)
SMILES OC(=O)C=CC1=CC=CC=C1
InChI Key WBYWAXJHAXSJNI-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-PR307042
Version
Author
Maintainer
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MetadataPublished 2019-03-28
Related Molecule
  • 3-phenylprop-2-enoic acid
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DTXSID40110056 EPA CompTox Dashboard
    CINMAC CCDC
    MTBLC27386 Metabolights
    27386 ChEBI
    MCULE-4051659199 Mcule
    8784 PubChem
    10006448 NMRShiftDB
    PD013623 ProbesDrugs
    9045-22-1 ACToR
    104521-37-1 ACToR
    101921-26-0 ACToR
    The data in this table is sourced from UniChem at EBI.