Dataset

Quinupramine

This MassBank record with Accession MSBNK-Waters-WA002031 contains the MS mass spectrum of Quinupramine with the InChIkey JCBQCKFFSPGEDY-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C21H24N2/c1-3-7-19-16(5-1)9-10-17-6-2-4-8-20(17)23(19)21-15-22-13-11-18(21)12-14-22/h1-8,18,21H,9-15H2
SMILES c(c5)cc(C3)c(c5)N(c(c4)c(ccc4)C3)C(C1)C(C2)CCN(C2)1
InChI Key JCBQCKFFSPGEDY-UHFFFAOYSA-N
Molecular Formula C21H24N2
Exact Mass 304.194 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002031
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:34:59.089075
MetadataModified 2025-02-09T20:24:10.433170
MetadataPublished 2016-01-19
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
PD073193 ProbesDrugs
14825434 PubChem: Thomson Pharma
31721-17-2 ACToR
SCHEMBL49100 SureChEMBL
93154 PubChem
DB13246 DrugBank
HMDB0257058 Human Metabolome Database
2348 DrugCentral
QUINUPRAMINE rxnorm
135292 ChEBI
29O61HFF4L FDA SRS
J20.064F Nikkaji
BEWDOW CCDC
12015548 PubChem: Drugs of the Future
CHEMBL107360 ChEMBL
The data in this table is sourced from UniChem at EBI.