3-({(2S,4R)-4-Hydroxy-2-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl}methyl)benzonitrile
11517
Reference
3-({(2S,4R)-4-Hydroxy-2-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl}methyl)benzonitrile Structure
Systematic / IUPAC Name: 3-[[(2S,4R)-4-Hydroxy-2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methyl]benzonitrile
ID: Reference11517
Other Names: NAT18-349026
Formula: C19H17N5O2
Spectral Data
3-({(2S,4R)-4-Hydroxy-2-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl}methyl)benzonitrile 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 | 975 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 6/28/2022 10:03:49 AM |
Identificators
| InChI | InChI=1S/C19H17N5O2/c20-9-13-3-1-4-14(7-13)11-24-12-16(25)8-17(24)19-22-18(23-26-19)15-5-2-6-21-10-15/h1-7,10,16-17,25H,8,11-12H2/t16-,17+/m1/s1 |
| InChI Key | PQHHIISBDHRVRA-SJORKVTESA-N |
| Canonical SMILES | C1C(CN(C1C2=NC(=NO2)C3=CN=CC=C3)CC4=CC(=CC=C4)C#N)O |
| CAS | |
| Splash | |
| Other Names | NAT18-349026 |