Dataset

Ryscinic Acid

This MassBank record with Accession MSBNK-Washington_State_Univ-BML82121 contains the MS mass spectrum of Ryscinic Acid with the InChIkey JOTXKBDAQVLFAX-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C7H6N2O2/c1-9-3-2-6(10)5(4-8)7(9)11/h2-3,10H,1H3
SMILES CN1C=CC(=C(C1=O)C#N)O
InChI Key JOTXKBDAQVLFAX-UHFFFAOYSA-N
Molecular Formula C7H6N2O2
Exact Mass 150.043 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML82121
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:27:33.893424
MetadataModified 2024-01-11T22:27:34.050553
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
4790079 eMolecules
CHEMBL1406836 ChEMBL
ZINC000006494657 ZINC
J2.364.961F Nikkaji
DTXSID00715783 EPA CompTox Dashboard
MCULE-7247762992 Mcule
SCHEMBL259368 SureChEMBL
54686421 PubChem
520-78-5 ACToR
The data in this table is sourced from UniChem at EBI.