1-[(1S,3S)-3-({5-[(Dimethylamino)methyl]-1,2-oxazol-3-yl}methyl)-2,2-dimethylcyclobutyl]-3-isopropylurea
11651
Reference
1-[(1S,3S)-3-({5-[(Dimethylamino)methyl]-1,2-oxazol-3-yl}methyl)-2,2-dimethylcyclobutyl]-3-isopropylurea Structure
Systematic / IUPAC Name: 1-[(1S,3S)-3-[[5-[(Dimethylamino)methyl]-1,2-oxazol-3-yl]methyl]-2,2-dimethylcyclobutyl]-3-propan-2-ylurea
ID: Reference11651
Other Names: NAT26-503564
Formula: C17H30N4O2
Spectral Data
1-[(1S,3S)-3-({5-[(Dimethylamino)methyl]-1,2-oxazol-3-yl}methyl)-2,2-dimethylcyclobutyl]-3-isopropylurea 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 | 746 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 8/12/2022 7:18:40 AM |
Identificators
| InChI | InChI=1S/C17H30N4O2/c1-11(2)18-16(22)19-15-8-12(17(15,3)4)7-13-9-14(23-20-13)10-21(5)6/h9,11-12,15H,7-8,10H2,1-6H3,(H2,18,19,22)/t12-,15+/m1/s1 |
| InChI Key | PUGLCOHOGDNBTH-DOMZBBRYSA-N |
| Canonical SMILES | CC(C)NC(=O)NC1CC(C1(C)C)CC2=NOC(=C2)CN(C)C |
| CAS | |
| Splash | |
| Other Names | NAT26-503564 |