1-Isopropyl-3-{[(2R,4S,5R)-5-{[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]methyl}-1-azabicyclo[2.2.2]oct-2-yl]methyl}urea
10818
Reference
1-Isopropyl-3-{[(2R,4S,5R)-5-{[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]methyl}-1-azabicyclo[2.2.2]oct-2-yl]methyl}urea Structure
Systematic / IUPAC Name: 1-[[(2R,4S,5R)-5-[[(2R)-2-(Methoxymethyl)pyrrolidin-1-yl]methyl]-1-azabicyclo[2.2.2]octan-2-yl]methyl]-3-propan-2-ylurea
ID: Reference10818
Other Names: NAT13-339849
Formula: C19H36N4O2
Spectral Data
1-Isopropyl-3-{[(2R,4S,5R)-5-{[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]methyl}-1-azabicyclo[2.2.2]oct-2-yl]methyl}urea 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 | 1540 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 9/2/2021 10:16:56 AM |
Identificators
| InChI | InChI=1S/C19H36N4O2/c1-14(2)21-19(24)20-10-18-9-15-6-8-23(18)12-16(15)11-22-7-4-5-17(22)13-25-3/h14-18H,4-13H2,1-3H3,(H2,20,21,24)/t15-,16-,17+,18+/m0/s1 |
| InChI Key | SOZNBMHVMPDFQK-WNRNVDISSA-N |
| Canonical SMILES | CC(C)NC(=O)NCC1CC2CCN1CC2CN3CCCC3COC |
| CAS | |
| Splash | |
| Other Names | NAT13-339849 |