(3R,5S)-1-[4-(Methylsulfonyl)benzyl]-5-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinol
12095
Reference
(3R,5S)-1-[4-(Methylsulfonyl)benzyl]-5-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinol Structure
Systematic / IUPAC Name: (3R,5S)-1-[(4-Methylsulfonylphenyl)methyl]-5-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-ol
ID: Reference12095
Other Names: NAT18-348678
Formula: C19H20N4O4S
Spectral Data
(3R,5S)-1-[4-(Methylsulfonyl)benzyl]-5-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]-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 | 885 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 1/5/2023 9:18:34 AM |
Identificators
| InChI | InChI=1S/C19H20N4O4S/c1-28(25,26)15-7-5-13(6-8-15)11-23-12-14(24)10-17(23)19-21-18(22-27-19)16-4-2-3-9-20-16/h2-9,14,17,24H,10-12H2,1H3/t14-,17+/m1/s1 |
| InChI Key | GQOKUVUMUNNFOP-PBHICJAKSA-N |
| Canonical SMILES | CS(=O)(=O)C1=CC=C(C=C1)CN2CC(CC2C3=NC(=NO3)C4=CC=CC=N4)O |
| CAS | |
| Splash | |
| Other Names | NAT18-348678 |