(8aS)-2-(4-Fluorobenzyl)-7-(methylsulfonyl)hexahydroimidazo[1,5-a]pyrazin-3(2H)-one
11969
Reference
(8aS)-2-(4-Fluorobenzyl)-7-(methylsulfonyl)hexahydroimidazo[1,5-a]pyrazin-3(2H)-one Structure
Systematic / IUPAC Name: (8aS)-2-[(4-Fluorophenyl)methyl]-7-methylsulfonyl-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one
ID: Reference11969
Other Names: NAT50-554968
Formula: C14H18FN3O3S
Spectral Data
(8aS)-2-(4-Fluorobenzyl)-7-(methylsulfonyl)hexahydroimidazo[1,5-a]pyrazin-3(2H)-one 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 | 1147 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/16/2022 10:36:02 AM |
Identificators
| InChI | InChI=1S/C14H18FN3O3S/c1-22(20,21)17-6-7-18-13(10-17)9-16(14(18)19)8-11-2-4-12(15)5-3-11/h2-5,13H,6-10H2,1H3/t13-/m0/s1 |
| InChI Key | AXNUIMOKDIACGN-ZDUSSCGKSA-N |
| Canonical SMILES | CS(=O)(=O)N1CCN2C(C1)CN(C2=O)CC3=CC=C(C=C3)F |
| CAS | |
| Splash | |
| Other Names | NAT50-554968 |