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

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

ID: Reference9086

Other Names: Propanamide, N-[[(2R,4S,5R)-5-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-2,2-dimethyl-;
NAT13-338566

Formula: C25H36N4O3

Spectral Data

N-({(2R,4S,5R)-5-[3-(3,4-Dimethoxyphenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-2,2-dimethylpropanamide 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 2490
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 11/7/2019 7:54:47 AM
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Identificators

InChI InChI=1S/C25H36N4O3/c1-25(2,3)24(30)26-14-18-11-16-9-10-29(18)15-19(16)21-13-20(27-28(21)4)17-7-8-22(31-5)23(12-17)32-6/h7-8,12-13,16,18-19H,9-11,14-15H2,1-6H3,(H,26,30)/t16-,18+,19-/m0/s1
InChI Key FFSCWMCXOMDFOS-UHOSZYNNSA-N
Canonical SMILES CC(C)(C)C(=O)NCC1CC2CCN1CC2C3=CC(=NN3C)C4=CC(=C(C=C4)OC)OC
CAS
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Other Names Propanamide, N-[[(2R,4S,5R)-5-[3-(3,4-dimethoxyphenyl)-1-methyl-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-2,2-dimethyl-;
NAT13-338566

In Other Databases

PubChem 40779513
ChemSpider 21381180