Systematic / IUPAC Name: 2-(4-Methylphenyl)-5-[(3S)-1-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]-1,3,4-oxadiazole
ID: Reference9533
Other Names:
1,3,4-Oxadiazole, 2-(4-methylphenyl)-5-[(3S)-1-[[4-(trifluoromethyl)phenyl]methyl]-3-pyrrolidinyl]-;
NAT31-459547
Formula: C21H20F3N3O
2-(4-Methylphenyl)-5-{(3S)-1-[4-(trifluoromethyl)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.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 714 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 3/26/2020 5:01:36 PM |
InChI | InChI=1S/C21H20F3N3O/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)21(22,23)24/h2-9,17H,10-13H2,1H3/t17-/m0/s1 |
InChI Key | PJTPUQOCVBOMQL-KRWDZBQOSA-N |
Canonical SMILES | CC1=CC=C(C=C1)C2=NN=C(O2)C3CCN(C3)CC4=CC=C(C=C4)C(F)(F)F |
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Other Names |
1,3,4-Oxadiazole, 2-(4-methylphenyl)-5-[(3S)-1-[[4-(trifluoromethyl)phenyl]methyl]-3-pyrrolidinyl]-; NAT31-459547 |