(3R,4S,6R)-6-{[4-(2-Hydroxy-2-propanyl)-1H-1,2,3-triazol-1-yl]methyl}-N-phenylquinuclidine-3-carboxamide

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Systematic / IUPAC Name: (3R,4S,6R)-6-[[4-(2-Hydroxypropan-2-yl)triazol-1-yl]methyl]-N-phenyl-1-azabicyclo[2.2.2]octane-3-carboxamide

ID: Reference8903

Other Names: 1-Azabicyclo[2.2.2]octane-3-carboxamide, 6-[[4-(1-hydroxy-1-methylethyl)-1H-1,2,3-triazol-1-yl]methyl]-N-phenyl-, (3R,4S,6R)-;
NAT13-309329

Formula: C20H27N5O2

Spectral Data

(3R,4S,6R)-6-{[4-(2-Hydroxy-2-propanyl)-1H-1,2,3-triazol-1-yl]methyl}-N-phenylquinuclidine-3-carboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 2157
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 9/5/2019 12:56:42 PM
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Identificators

InChI InChI=1S/C20H27N5O2/c1-20(2,27)18-13-25(23-22-18)11-16-10-14-8-9-24(16)12-17(14)19(26)21-15-6-4-3-5-7-15/h3-7,13-14,16-17,27H,8-12H2,1-2H3,(H,21,26)/t14-,16+,17-/m0/s1
InChI Key PWDMLAUPZUYCJM-UAGQMJEPSA-N
Canonical SMILES CC(C)(C1=CN(N=N1)CC2CC3CCN2CC3C(=O)NC4=CC=CC=C4)O
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Other Names 1-Azabicyclo[2.2.2]octane-3-carboxamide, 6-[[4-(1-hydroxy-1-methylethyl)-1H-1,2,3-triazol-1-yl]methyl]-N-phenyl-, (3R,4S,6R)-;
NAT13-309329

In Other Databases

ChemSpider 10116452
PubChem 11942133