N-({(2R,4S,5R)-5-[6-(2-Furyl)-2-methyl-4-pyrimidinyl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)methanesulfonamide
13005
Reference
N-({(2R,4S,5R)-5-[6-(2-Furyl)-2-methyl-4-pyrimidinyl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)methanesulfonamide Structure
Systematic / IUPAC Name: N-[[(2R,4S,5R)-5-[6-(Furan-2-yl)-2-methylpyrimidin-4-yl]-1-azabicyclo[2.2.2]octan-2-yl]methyl]methanesulfonamide
ID: Reference13005
Other Names: NAT13-342959
Formula: C18H24N4O3S
Spectral Data
N-({(2R,4S,5R)-5-[6-(2-Furyl)-2-methyl-4-pyrimidinyl]-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.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 580 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/9/2024 8:59:16 AM |
Identificators
| InChI | InChI=1S/C18H24N4O3S/c1-12-20-16(9-17(21-12)18-4-3-7-25-18)15-11-22-6-5-13(15)8-14(22)10-19-26(2,23)24/h3-4,7,9,13-15,19H,5-6,8,10-11H2,1-2H3/t13-,14+,15-/m0/s1 |
| InChI Key | CHTDMWJAAWLTCK-ZNMIVQPWSA-N |
| Canonical SMILES | CC1=NC(=CC(=N1)C2CN3CCC2CC3CNS(=O)(=O)C)C4=CC=CO4 |
| CAS | |
| Splash | |
| Other Names | NAT13-342959 |