Dataset

3-Hydroxycinnamic acid

This MassBank record with Accession MSBNK-RIKEN-PR305570 contains the MS2 mass spectrum of 3-Hydroxycinnamic acid with the InChIkey KKSDGJDHHZEWEP-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12)
SMILES OC(=O)C=CC1=CC(O)=CC=C1
InChI Key KKSDGJDHHZEWEP-UHFFFAOYSA-N
Molecular Formula C9H8O3
Exact Mass 164.160 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-PR305570
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:05:10.966837
MetadataModified 2025-02-09T18:29:51.148788
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
ZZZFKS CCDC
47925 ChEBI
11496 PubChem
PD088210 ProbesDrugs
10008843 NMRShiftDB
MCULE-2569094851 Mcule
MTBLC47925 Metabolights
The data in this table is sourced from UniChem at EBI.