Systematic / IUPAC Name: (8aR)-2-Cyclohexyl-7-(2,2-dimethylpropyl)-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one
ID: Reference12553
Other Names: NAT50-557315
Formula: C17H31N3O
(8aR)-2-Cyclohexyl-7-(2,2-dimethylpropyl)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.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 800 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 5/26/2023 1:11:54 PM |
InChI | InChI=1S/C17H31N3O/c1-17(2,3)13-18-9-10-19-15(11-18)12-20(16(19)21)14-7-5-4-6-8-14/h14-15H,4-13H2,1-3H3/t15-/m1/s1 |
InChI Key | PFWHABJQOYVRSR-OAHLLOKOSA-N |
Canonical SMILES | CC(C)(C)CN1CCN2C(C1)CN(C2=O)C3CCCCC3 |
CAS | |
Splash | |
Other Names | NAT50-557315 |
PubChem | 75368650 |
ChEMBL | CHEMBL3437002 |
ChemSpider | 29856441 |