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

ID: Reference9074

Other Names: Benzamide, N-[[(2R,4S,5R)-5-(3-cyclopentyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl]-4-methoxy-;
NAT13-334361

Formula: C25H34N4O2

Spectral Data

N-{[(2R,4S,5R)-5-(3-Cyclopentyl-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 1280
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 11/4/2019 12:29:46 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C25H34N4O2/c1-28-24(14-23(27-28)17-5-3-4-6-17)22-16-29-12-11-19(22)13-20(29)15-26-25(30)18-7-9-21(31-2)10-8-18/h7-10,14,17,19-20,22H,3-6,11-13,15-16H2,1-2H3,(H,26,30)/t19-,20+,22-/m0/s1
InChI Key LVYYHPKYWYSATM-VWPQPMDRSA-N
Canonical SMILES CN1C(=CC(=N1)C2CCCC2)C3CN4CCC3CC4CNC(=O)C5=CC=C(C=C5)OC
CAS
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Other Names Benzamide, N-[[(2R,4S,5R)-5-(3-cyclopentyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl]-4-methoxy-;
NAT13-334361

In Other Databases

PubChem 25389060
ChemSpider 21381043