Systematic / IUPAC Name: N-[[(2R,4S,5R)-5-(2-Methyl-5-naphthalen-2-ylpyrazol-3-yl)-1-azabicyclo[2.2.2]octan-2-yl]methyl]-2-phenoxyacetamide
ID: Reference9051
Other Names:
Acetamide, N-[[(2R,4S,5R)-5-[1-methyl-3-(2-naphthalenyl)-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-2-phenoxy-;
NAT13-338079
Formula: C30H32N4O2
N-({(2R,4S,5R)-5-[1-Methyl-3-(2-naphthyl)-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-2-phenoxyacetamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 1 |
No. of Spectra | 858 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 10/25/2019 11:56:19 AM |
InChI | InChI=1S/C30H32N4O2/c1-33-29(17-28(32-33)24-12-11-21-7-5-6-8-22(21)15-24)27-19-34-14-13-23(27)16-25(34)18-31-30(35)20-36-26-9-3-2-4-10-26/h2-12,15,17,23,25,27H,13-14,16,18-20H2,1H3,(H,31,35)/t23-,25+,27-/m0/s1 |
InChI Key | JXZJZZIJBKKQAJ-RELGLDOUSA-N |
Canonical SMILES | CN1C(=CC(=N1)C2=CC3=CC=CC=C3C=C2)C4CN5CCC4CC5CNC(=O)COC6=CC=CC=C6 |
CAS | |
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Other Names |
Acetamide, N-[[(2R,4S,5R)-5-[1-methyl-3-(2-naphthalenyl)-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-2-phenoxy-; NAT13-338079 |