Dataset

Succinic acid

This MassBank record with Accession MSBNK-Eawag-EQ01155051 contains the MS2 mass spectrum of Succinic acid with the InChIkey KDYFGRWQOYBRFD-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
SMILES C(CC(=O)O)C(=O)O
InChI Key KDYFGRWQOYBRFD-UHFFFAOYSA-N
Molecular Formula C4H6O4
Exact Mass 118.027 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-Eawag-EQ01155051
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T09:57:37.359734
MetadataModified 2025-02-09T09:57:37.536696
MetadataPublished 2024-05-08
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
26121 BindingDB
SUCACB CCDC
J2.879G Nikkaji
HY-N0420 MedChemExpress
SUCCINIC ACID clinicaltrials
3637 Guide to Pharmacology
SUCCINIC ACID rxnorm
SUCCINIC ACID DailyMed
2487 DrugCentral
LMFA01170043 LipidMaps
DTXSID6023602 EPA CompTox Dashboard
103665 Brenda
CHEMBL576 ChEMBL
C00042 KEGG Ligand
DB00139 DrugBank
15741 ChEBI
SIN PDBe
1110 PubChem
PD010208 ProbesDrugs
AB6MNQ6J6L FDA SRS
15321249 PubChem: Thomson Pharma
110-15-6 ACToR
481572 eMolecules
succinic acid DailyMed
ZINC000000895030 ZINC
MTBLC15741 Metabolights
2759 Brenda
58 Brenda
97700 Brenda
93193 Brenda
CB9852802 ChemicalBook
137838 Brenda
105625 Brenda
HMDB0000254 Human Metabolome Database
10008686 NMRShiftDB
MCULE-5889111640 Mcule
21952380 PubChem
SCHEMBL829 SureChEMBL
The data in this table is sourced from UniChem at EBI.