(3R,5S)-1-{[5-(Hydroxymethyl)-2-furyl]methyl}-5-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-3-pyrrolidinol
11075
Reference
(3R,5S)-1-{[5-(Hydroxymethyl)-2-furyl]methyl}-5-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-3-pyrrolidinol Structure
Systematic / IUPAC Name: (3R,5S)-1-[[5-(Hydroxymethyl)furan-2-yl]methyl]-5-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-3-ol
ID: Reference11075
Other Names: NAT18-348531
Formula: C19H18F3N3O4
Spectral Data
(3R,5S)-1-{[5-(Hydroxymethyl)-2-furyl]methyl}-5-{3-[4-(trifluoromethyl)phenyl]-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 | 1190 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/26/2021 11:03:47 AM |
Identificators
| InChI | InChI=1S/C19H18F3N3O4/c20-19(21,22)12-3-1-11(2-4-12)17-23-18(29-24-17)16-7-13(27)8-25(16)9-14-5-6-15(10-26)28-14/h1-6,13,16,26-27H,7-10H2/t13-,16+/m1/s1 |
| InChI Key | CAPBNTVYDZYAPY-CJNGLKHVSA-N |
| Canonical SMILES | C1C(CN(C1C2=NC(=NO2)C3=CC=C(C=C3)C(F)(F)F)CC4=CC=C(O4)CO)O |
| CAS | |
| Splash | |
| Other Names | NAT18-348531 |