4-Chloro-N-{[(2R,4S,5R)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1-azabicyclo[2.2.2]oct-2-yl]methyl}benzenesulfonamide
10576
Reference
4-Chloro-N-{[(2R,4S,5R)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1-azabicyclo[2.2.2]oct-2-yl]methyl}benzenesulfonamide Structure
Systematic / IUPAC Name: 4-Chloro-N-[[(2R,4S,5R)-5-(2,3-dihydroindol-1-ylmethyl)-1-azabicyclo[2.2.2]octan-2-yl]methyl]benzenesulfonamide
ID: Reference10576
Other Names: NAT13-339823
Formula: C23H28ClN3O2S
Spectral Data
4-Chloro-N-{[(2R,4S,5R)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1-azabicyclo[2.2.2]oct-2-yl]methyl}benzenesulfonamide 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 | 1035 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 6/18/2021 10:05:03 AM |
Identificators
| InChI | InChI=1S/C23H28ClN3O2S/c24-20-5-7-22(8-6-20)30(28,29)25-14-21-13-18-10-11-26(21)15-19(18)16-27-12-9-17-3-1-2-4-23(17)27/h1-8,18-19,21,25H,9-16H2/t18-,19+,21+/m0/s1 |
| InChI Key | GJZKYBUJSXBBEE-QKNQBKEWSA-N |
| Canonical SMILES | C1CN2CC(C1CC2CNS(=O)(=O)C3=CC=C(C=C3)Cl)CN4CCC5=CC=CC=C54 |
| CAS | |
| Splash | |
| Other Names | NAT13-339823 |