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

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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]-2-methoxyacetamide

ID: Reference9046

Other Names: Acetamide, N-[[(2R,4S,5R)-5-[3-(4-fluorophenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-2-methoxy-;
NAT13-333873

Formula: C21H27FN4O2

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)-2-methoxyacetamide 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 2252
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 10/25/2019 7:23:01 AM
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Identificators

InChI InChI=1S/C21H27FN4O2/c1-25-20(10-19(24-25)14-3-5-16(22)6-4-14)18-12-26-8-7-15(18)9-17(26)11-23-21(27)13-28-2/h3-6,10,15,17-18H,7-9,11-13H2,1-2H3,(H,23,27)/t15-,17+,18-/m0/s1
InChI Key DIHJZJDEIBRUFJ-JQHSSLGASA-N
Canonical SMILES CN1C(=CC(=N1)C2=CC=C(C=C2)F)C3CN4CCC3CC4CNC(=O)COC
CAS
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Other Names Acetamide, N-[[(2R,4S,5R)-5-[3-(4-fluorophenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-2-methoxy-;
NAT13-333873

In Other Databases

PubChem 25389016
ChemSpider 21381008