N-{[(2R,4S,5R)-5-(3-Cyclopentyl-1-methyl-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-(5-Cyclopentyl-2-methylpyrazol-3-yl)-1-azabicyclo[2.2.2]octan-2-yl]methyl]methanesulfonamide

ID: Reference9048

Other Names: Methanesulfonamide, N-[[(2R,4S,5R)-5-(3-cyclopentyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl]-;
NAT13-334379

Formula: C18H30N4O2S

Spectral Data

N-{[(2R,4S,5R)-5-(3-Cyclopentyl-1-methyl-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 455
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 10/25/2019 7:25:39 AM
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Identificators

InChI InChI=1S/C18H30N4O2S/c1-21-18(10-17(20-21)13-5-3-4-6-13)16-12-22-8-7-14(16)9-15(22)11-19-25(2,23)24/h10,13-16,19H,3-9,11-12H2,1-2H3/t14-,15+,16-/m0/s1
InChI Key OXISCWNJCVOSOZ-XHSDSOJGSA-N
Canonical SMILES CN1C(=CC(=N1)C2CCCC2)C3CN4CCC3CC4CNS(=O)(=O)C
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Other Names Methanesulfonamide, N-[[(2R,4S,5R)-5-(3-cyclopentyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl]-;
NAT13-334379

In Other Databases

ChemSpider 21381051
PubChem 25389078