Dataset

Ketoprofen

This MassBank record with Accession MSBNK-UFZ-UF408604 contains the MS2 mass spectrum of Ketoprofen with the InChIkey DKYWVDODHFEZIM-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)
SMILES CC(C(O)=O)C1=CC=CC(=C1)C(=O)C1=CC=CC=C1
InChI Key DKYWVDODHFEZIM-UHFFFAOYSA-N
Molecular Formula C16H14O3
Exact Mass 254.094 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF408604
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:56:40.683605
MetadataModified 2025-02-09T19:50:10.605056
MetadataPublished 2017-01-05
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
499326 eMolecules
PD001443 ProbesDrugs
KETOPROFEN LYSINE clinicaltrials
KETOPROFEN LYSINE SALT clinicaltrials
LSM-1955 LINCS
15122326 PubChem: Thomson Pharma
154907-35-4 ACToR
PA450149 PharmGKB
Ketoprofen(Actron) Selleck
22071-15-4 ACToR
135254 Brenda
104478 Brenda
ketoprofen DailyMed
CB3299418 ChemicalBook
HMDB0015144 Human Metabolome Database
55515 Brenda
SCHEMBL2896 SureChEMBL
20207463 NMRShiftDB
3825 PubChem
J389.200J Nikkaji
J389.199B Nikkaji
J3.468A Nikkaji
4795 Guide to Pharmacology
1528 DrugCentral
DTXSID6020771 EPA CompTox Dashboard
MCULE-9740144074 Mcule
90Y4QC304K FDA SRS
19583RP clinicaltrials
IDEA-033 clinicaltrials
ORUVAIL clinicaltrials
ORUDIS clinicaltrials
HY-B0227 MedChemExpress
DIRACTIN clinicaltrials
NEXCEDE clinicaltrials
RP-19583 clinicaltrials
ALRHEUMAT clinicaltrials
KETOPROFEN clinicaltrials
SECTOR clinicaltrials
ACTRON clinicaltrials
CAPISTEN clinicaltrials
KETOPROFEN DailyMed
KETOPROFEN rxnorm
50022271 BindingDB
C01716 KEGG Ligand
DB01009 DrugBank
CHEMBL571 ChEMBL
6128 ChEBI
SAM002264620 NIH Clinical Collection
The data in this table is sourced from UniChem at EBI.