Molecule

(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol

Chemical Information

28 Related Dataset(s) ⌄

13C nuclear magnetic resonance spectroscopy (13C NMR)

1H nuclear magnetic resonance spectroscopy (1H NMR)

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

1H--15N heteronuclear multiple bond coherence (15N-1H HMBC)

1H--1H correlation spectroscopy (1H-1H COSY)

1H--1H nuclear Overhauser enhancement spectroscopy (1H-1H NOESY)

Cinchonidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+

Cinchonidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+

Cinchonidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+

Cinchonidine; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+

Cinchonidine; LC-ESI-QQQ; MS; [M+H]+

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2

Cinchonidine; LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV

Cinchonidine; LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV

Cinchonidine; LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV

Cinchonidine; LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV

Cinchonidine; LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol6671
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
DB16831	drugbank
CHEBI:3703	chebi
CHEMBL533841	chembl
159532	surechembl
159533	surechembl
29506635	surechembl
101744	pubchem
1U622LRA8Z	fdasrs
PD001559	probes_and_drugs
CINDIN	CCDC
29857	brenda
Molport-003-665-608	molport
The data in this table is sourced from UniChem at EBI.