Dataset

6-(4-FLUOROPHENYL)-3,4-DIHYDROPYRIMIDIN-4-ONE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004453 contains the MS mass spectrum of 6-(4-FLUOROPHENYL)-3,4-DIHYDROPYRIMIDIN-4-ONE with the InChIkey UWDUMRWLLYZYBY-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H7FN2O/c11-8-3-1-7(2-4-8)9-5-10(14)13-6-12-9/h1-6H,(H,12,13,14)
SMILES Fc(c2)ccc(c2)C(N=1)=CC(=O)NC1
InChI Key UWDUMRWLLYZYBY-UHFFFAOYSA-N
Molecular Formula C10H7FN2O
Exact Mass 190.054 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-Fac_Eng_Univ_Tokyo-JP004453
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:55:32.881992
MetadataModified 2024-01-11T15:55:33.043582
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
MCULE-2315859376 Mcule
J47.171B Nikkaji
ZINC000026420672 ZINC
DTXSID30345552 EPA CompTox Dashboard
135679871 PubChem
27512161 eMolecules
The data in this table is sourced from UniChem at EBI.