Systematic / IUPAC Name: 2-[(3S)-1-[(4-Chlorophenyl)methyl]pyrrolidin-3-yl]-6-fluoro-1H-benzimidazole
ID: Reference11166
Other Names: NAT31-457198
Formula: C18H17ClFN3
2-[(3S)-1-(4-Chlorobenzyl)-3-pyrrolidinyl]-5-fluoro-1H-benzimidazole 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 | 520 |
Tandem Spectra | MS1, MS2, MS3 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 1/28/2022 8:37:42 AM |
InChI | InChI=1S/C18H17ClFN3/c19-14-3-1-12(2-4-14)10-23-8-7-13(11-23)18-21-16-6-5-15(20)9-17(16)22-18/h1-6,9,13H,7-8,10-11H2,(H,21,22)/t13-/m0/s1 |
InChI Key | YKWBVMSKVHRDJR-ZDUSSCGKSA-N |
Canonical SMILES | C1CN(CC1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC=C(C=C4)Cl |
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Other Names | NAT31-457198 |