Dataset

1,9-dimethyluric acid

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01730 contains the MS2 mass spectrum of 1,9-dimethyluric acid with the InChIkey UARKDOLETOEBCU-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C7H8N4O3/c1-10-4-3(8-6(10)13)5(12)11(2)7(14)9-4/h1-2H3,(H,8,13)(H,9,14)
SMILES CN1C2=C(C(=O)N(C(=O)N2)C)NC1=O
InChI Key UARKDOLETOEBCU-UHFFFAOYSA-N
Molecular Formula C7H8N4O3
Exact Mass 196.060 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-BML01730
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:26:48.070644
MetadataModified 2024-01-11T22:26:48.243048
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
505030 eMolecules
55441-62-8 ACToR
ZINC000002584392 ZINC
MCULE-5253878859 Mcule
HMDB0002026 Human Metabolome Database
SCHEMBL21594812 SureChEMBL
108712 PubChem
J266.994C Nikkaji
173963 ChEBI
The data in this table is sourced from UniChem at EBI.