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

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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]acetamide

ID: Reference8984

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]-;
NAT13-333886

Formula: C20H25FN4O

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)acetamide 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 1674
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 10/14/2019 12:04:14 PM
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Identificators

InChI InChI=1S/C20H25FN4O/c1-13(26)22-11-17-9-15-7-8-25(17)12-18(15)20-10-19(23-24(20)2)14-3-5-16(21)6-4-14/h3-6,10,15,17-18H,7-9,11-12H2,1-2H3,(H,22,26)/t15-,17+,18-/m0/s1
InChI Key KFYVBMYHYXUOGK-JQHSSLGASA-N
Canonical SMILES CC(=O)NCC1CC2CCN1CC2C3=CC(=NN3C)C4=CC=C(C=C4)F
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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]-;
NAT13-333886

In Other Databases

PubChem 25389034
ChemSpider 21381014