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

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

ID: Reference9069

Other Names: Methanesulfonamide, N-[[(2R,4S,5R)-5-(1-methyl-3-phenyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl]-;
NAT13-332219

Formula: C19H26N4O2S

Spectral Data

N-{[(2R,4S,5R)-5-(1-Methyl-3-phenyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl}methanesulfonamide 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 464
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 11/4/2019 11:36:02 AM
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Identificators

InChI InChI=1S/C19H26N4O2S/c1-22-19(11-18(21-22)14-6-4-3-5-7-14)17-13-23-9-8-15(17)10-16(23)12-20-26(2,24)25/h3-7,11,15-17,20H,8-10,12-13H2,1-2H3/t15-,16+,17-/m0/s1
InChI Key FMBQBWCUWJDZFQ-BBWFWOEESA-N
Canonical SMILES CN1C(=CC(=N1)C2=CC=CC=C2)C3CN4CCC3CC4CNS(=O)(=O)C
CAS
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Other Names Methanesulfonamide, N-[[(2R,4S,5R)-5-(1-methyl-3-phenyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl]-;
NAT13-332219

In Other Databases

ChEMBL CHEMBL3437432
PubChem 40779189
ChemSpider 21380788