1-Isopropyl-3-{(4R,7S,8aS)-1-oxo-4-[3-oxo-3-(1-pyrrolidinyl)propyl]octahydropyrrolo[1,2-a]pyrazin-7-yl}urea
11925
Reference
1-Isopropyl-3-{(4R,7S,8aS)-1-oxo-4-[3-oxo-3-(1-pyrrolidinyl)propyl]octahydropyrrolo[1,2-a]pyrazin-7-yl}urea Structure
Systematic / IUPAC Name: 1-[(4R,7S,8aS)-1-Oxo-4-(3-oxo-3-pyrrolidin-1-ylpropyl)-3,4,6,7,8,8a-hexahydro-2H-pyrrolo[1,2-a]pyrazin-7-yl]-3-propan-2-ylurea
ID: Reference11925
Other Names: NAT23-379236
Formula: C18H31N5O3
Spectral Data
1-Isopropyl-3-{(4R,7S,8aS)-1-oxo-4-[3-oxo-3-(1-pyrrolidinyl)propyl]octahydropyrrolo[1,2-a]pyrazin-7-yl}urea 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 | 1379 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/7/2022 12:31:55 PM |
Identificators
| InChI | InChI=1S/C18H31N5O3/c1-12(2)20-18(26)21-13-9-15-17(25)19-10-14(23(15)11-13)5-6-16(24)22-7-3-4-8-22/h12-15H,3-11H2,1-2H3,(H,19,25)(H2,20,21,26)/t13-,14+,15-/m0/s1 |
| InChI Key | PNTYTMVJGCDOSJ-ZNMIVQPWSA-N |
| Canonical SMILES | CC(C)NC(=O)NC1CC2C(=O)NCC(N2C1)CCC(=O)N3CCCC3 |
| CAS | |
| Splash | |
| Other Names | NAT23-379236 |