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-[(4-fluorophenyl)methyl]propanamide
ID: Reference10945
Other Names:
Pyrrolo[1,2-a]pyrazine-4-propanamide, N-[(4-fluorophenyl)methyl]-7-[[(4-fluorophenyl)methyl]amino]octahydro-1-oxo-, (4R,7S,8aS)-;
NAT23-379401
Formula: C24H28F2N4O2
N-(4-Fluorobenzyl)-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.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 2136 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 10/15/2021 10:29:45 AM |
InChI | InChI=1S/C24H28F2N4O2/c25-18-5-1-16(2-6-18)12-27-20-11-22-24(32)29-14-21(30(22)15-20)9-10-23(31)28-13-17-3-7-19(26)8-4-17/h1-8,20-22,27H,9-15H2,(H,28,31)(H,29,32)/t20-,21+,22-/m0/s1 |
InChI Key | SJYHEDIXAGOJHE-BDTNDASRSA-N |
Canonical SMILES | C1C(CN2C1C(=O)NCC2CCC(=O)NCC3=CC=C(C=C3)F)NCC4=CC=C(C=C4)F |
CAS | |
Splash | |
Other Names |
Pyrrolo[1,2-a]pyrazine-4-propanamide, N-[(4-fluorophenyl)methyl]-7-[[(4-fluorophenyl)methyl]amino]octahydro-1-oxo-, (4R,7S,8aS)-; NAT23-379401 |