N,N-Diethyl-3-{(4R,7S,8aS)-7-[(4-fluorobenzyl)amino]-1-oxooctahydropyrrolo[1,2-a]pyrazin-4-yl}propanamide
11209
Reference
N,N-Diethyl-3-{(4R,7S,8aS)-7-[(4-fluorobenzyl)amino]-1-oxooctahydropyrrolo[1,2-a]pyrazin-4-yl}propanamide Structure
Systematic / IUPAC Name: 3-[(4R,7S,8aS)-7-[(4-Fluorophenyl)methylamino]-1-oxo-3,4,6,7,8,8a-hexahydro-2H-pyrrolo[1,2-a]pyrazin-4-yl]-N,N-diethylpropanamide
ID: Reference11209
Other Names: NAT23-380506
Formula: C21H31FN4O2
Spectral Data
N,N-Diethyl-3-{(4R,7S,8aS)-7-[(4-fluorobenzyl)amino]-1-oxooctahydropyrrolo[1,2-a]pyrazin-4-yl}propanamide 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 | 1894 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/11/2022 8:58:25 AM |
Identificators
| InChI | InChI=1S/C21H31FN4O2/c1-3-25(4-2)20(27)10-9-18-13-24-21(28)19-11-17(14-26(18)19)23-12-15-5-7-16(22)8-6-15/h5-8,17-19,23H,3-4,9-14H2,1-2H3,(H,24,28)/t17-,18+,19-/m0/s1 |
| InChI Key | VWXCDQOMNYUFQG-OTWHNJEPSA-N |
| Canonical SMILES | CCN(CC)C(=O)CCC1CNC(=O)C2N1CC(C2)NCC3=CC=C(C=C3)F |
| CAS | |
| Splash | |
| Other Names | NAT23-380506 |