N-({(2R,4S,5R)-5-[3-(4-Fluorophenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-4-methoxybenzamide

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Systematic / IUPAC Name: N-[[(2R,4S,5R)-5-[5-(4-Fluorophenyl)-2-methylpyrazol-3-yl]-1-azabicyclo[2.2.2]octan-2-yl]methyl]-4-methoxybenzamide

ID: Reference9072

Other Names: Benzamide, N-[[(2R,4S,5R)-5-[3-(4-fluorophenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-4-methoxy-;
NAT13-333881

Formula: C26H29FN4O2

Spectral Data

N-({(2R,4S,5R)-5-[3-(4-Fluorophenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-4-methoxybenzamide 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 2
No. of Spectra 1675
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 11/4/2019 12:20:30 PM
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Identificators

InChI InChI=1S/C26H29FN4O2/c1-30-25(14-24(29-30)17-3-7-20(27)8-4-17)23-16-31-12-11-19(23)13-21(31)15-28-26(32)18-5-9-22(33-2)10-6-18/h3-10,14,19,21,23H,11-13,15-16H2,1-2H3,(H,28,32)/t19-,21+,23-/m0/s1
InChI Key XNQKIMQOJHGNIR-WPYKKVEZSA-N
Canonical SMILES CN1C(=CC(=N1)C2=CC=C(C=C2)F)C3CN4CCC3CC4CNC(=O)C5=CC=C(C=C5)OC
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Other Names Benzamide, N-[[(2R,4S,5R)-5-[3-(4-fluorophenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-4-methoxy-;
NAT13-333881

In Other Databases

ChemSpider 21381012
PubChem 25389028