3-{(4R,7S,8aS)-7-[(4-Fluorobenzyl)amino]-1-oxooctahydropyrrolo[1,2-a]pyrazin-4-yl}-N-(4-methoxybenzyl)propanamide

enlarge

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-methoxyphenyl)methyl]propanamide

ID: Reference12450

Other Names: NAT23-379466

Formula: C25H31FN4O3

Spectral Data

3-{(4R,7S,8aS)-7-[(4-Fluorobenzyl)amino]-1-oxooctahydropyrrolo[1,2-a]pyrazin-4-yl}-N-(4-methoxybenzyl)propanamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2205
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/17/2023 10:39:57 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C25H31FN4O3/c1-33-22-9-4-18(5-10-22)14-28-24(31)11-8-21-15-29-25(32)23-12-20(16-30(21)23)27-13-17-2-6-19(26)7-3-17/h2-7,9-10,20-21,23,27H,8,11-16H2,1H3,(H,28,31)(H,29,32)/t20-,21+,23-/m0/s1
InChI Key GLLNNGRDHVIGFK-XJUOHMSHSA-N
Canonical SMILES COC1=CC=C(C=C1)CNC(=O)CCC2CNC(=O)C3N2CC(C3)NCC4=CC=C(C=C4)F
CAS
Splash
Other Names NAT23-379466

In Other Databases

PubChem 45360662
ChemSpider 21382538