2-[(3S)-1-(3,4-Difluorobenzyl)-3-pyrrolidinyl]-5-(trifluoromethyl)-1H-benzimidazole
10291
Reference
2-[(3S)-1-(3,4-Difluorobenzyl)-3-pyrrolidinyl]-5-(trifluoromethyl)-1H-benzimidazole Structure
Systematic / IUPAC Name: 2-[(3S)-1-[(3,4-Difluorophenyl)methyl]pyrrolidin-3-yl]-6-(trifluoromethyl)-1H-benzimidazole
ID: Reference10291
Other Names: NAT31-457558
Formula: C19H16F5N3
Spectral Data
2-[(3S)-1-(3,4-Difluorobenzyl)-3-pyrrolidinyl]-5-(trifluoromethyl)-1H-benzimidazole 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 | 2 |
| No. of Spectra | 1089 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 3/12/2021 12:21:56 PM |
Identificators
| InChI | InChI=1S/C19H16F5N3/c20-14-3-1-11(7-15(14)21)9-27-6-5-12(10-27)18-25-16-4-2-13(19(22,23)24)8-17(16)26-18/h1-4,7-8,12H,5-6,9-10H2,(H,25,26)/t12-/m0/s1 |
| InChI Key | DYTMRDALWIKGHQ-LBPRGKRZSA-N |
| Canonical SMILES | C1CN(CC1C2=NC3=C(N2)C=C(C=C3)C(F)(F)F)CC4=CC(=C(C=C4)F)F |
| CAS | |
| Splash | |
| Other Names | NAT31-457558 |