Dataset

Quinupramine; LC-ESI-Q; MS; POS; 90 V

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

Chemical Information

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

QuinupramineHTML

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Related Molecule ⌄

11-(1-azabicyclo[2.2.2]octan-3-yl)-5,6-dihydrobenzo[b][1]benzazepine

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
MetadataPublished	2016-01-19
Related Molecule	11-(1-azabicyclo[2.2.2]octan-3-yl)-5,6-dihydrobenzo[b][1]benzazepine

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
DB13246	drugbank
CHEBI:135292	chebi
CHEMBL107360	chembl
29985275	surechembl
49100	surechembl
93154	pubchem
29O61HFF4L	fdasrs
PD073193	probes_and_drugs
BEWDOW	CCDC
HMDB0257058	hmdb
DTXSID70865608	comptox
Molport-006-126-341	molport
2348	drugcentral
The data in this table is sourced from UniChem at EBI.