2-(4-Methylphenyl)-5-{(3S)-1-[4-(trifluoromethoxy)benzyl]-3-pyrrolidinyl}-1,3,4-oxadiazole
10353
Reference
2-(4-Methylphenyl)-5-{(3S)-1-[4-(trifluoromethoxy)benzyl]-3-pyrrolidinyl}-1,3,4-oxadiazole Structure
Systematic / IUPAC Name: 2-(4-Methylphenyl)-5-[(3S)-1-[[4-(trifluoromethoxy)phenyl]methyl]pyrrolidin-3-yl]-1,3,4-oxadiazole
ID: Reference10353
Other Names: NAT31-459508
Formula: C21H20F3N3O2
Spectral Data
2-(4-Methylphenyl)-5-{(3S)-1-[4-(trifluoromethoxy)benzyl]-3-pyrrolidinyl}-1,3,4-oxadiazole 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 | 1183 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 4/1/2021 1:26:00 PM |
Identificators
| InChI | InChI=1S/C21H20F3N3O2/c1-14-2-6-16(7-3-14)19-25-26-20(28-19)17-10-11-27(13-17)12-15-4-8-18(9-5-15)29-21(22,23)24/h2-9,17H,10-13H2,1H3/t17-/m0/s1 |
| InChI Key | GOSJBPRUNRYIKR-KRWDZBQOSA-N |
| Canonical SMILES | CC1=CC=C(C=C1)C2=NN=C(O2)C3CCN(C3)CC4=CC=C(C=C4)OC(F)(F)F |
| CAS | |
| Splash | |
| Other Names | NAT31-459508 |