(3R,5S)-5-[3-(2-Chloro-4-fluorobenzyl)-1,2,4-oxadiazol-5-yl]-1-(3-pyridinylmethyl)-3-pyrrolidinol
11107
Reference
(3R,5S)-5-[3-(2-Chloro-4-fluorobenzyl)-1,2,4-oxadiazol-5-yl]-1-(3-pyridinylmethyl)-3-pyrrolidinol Structure
Systematic / IUPAC Name: (3R,5S)-5-[3-[(2-Chloro-4-fluorophenyl)methyl]-1,2,4-oxadiazol-5-yl]-1-(pyridin-3-ylmethyl)pyrrolidin-3-ol
ID: Reference11107
Other Names: NAT18-382928
Formula: C19H18ClFN4O2
Spectral Data
(3R,5S)-5-[3-(2-Chloro-4-fluorobenzyl)-1,2,4-oxadiazol-5-yl]-1-(3-pyridinylmethyl)-3-pyrrolidinol 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 | 580 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/10/2021 11:31:47 AM |
Identificators
| InChI | InChI=1S/C19H18ClFN4O2/c20-16-7-14(21)4-3-13(16)6-18-23-19(27-24-18)17-8-15(26)11-25(17)10-12-2-1-5-22-9-12/h1-5,7,9,15,17,26H,6,8,10-11H2/t15-,17+/m1/s1 |
| InChI Key | FBEZEOLPHJRXSK-WBVHZDCISA-N |
| Canonical SMILES | C1C(CN(C1C2=NC(=NO2)CC3=C(C=C(C=C3)F)Cl)CC4=CN=CC=C4)O |
| CAS | |
| Splash | |
| Other Names | NAT18-382928 |