Systematic / IUPAC Name: 2-[(3S)-1-[(4-Fluorophenyl)methyl]pyrrolidin-3-yl]-3H-benzimidazole-5-carbonitrile
ID: Reference11855
Other Names: NAT31-457738
Formula: C19H17FN4
2-[(3S)-1-(4-Fluorobenzyl)-3-pyrrolidinyl]-1H-benzimidazole-5-carbonitrile 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 | 540 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 10/14/2022 11:25:23 AM |
InChI | InChI=1S/C19H17FN4/c20-16-4-1-13(2-5-16)11-24-8-7-15(12-24)19-22-17-6-3-14(10-21)9-18(17)23-19/h1-6,9,15H,7-8,11-12H2,(H,22,23)/t15-/m0/s1 |
InChI Key | RIXVBWHOVONMKO-HNNXBMFYSA-N |
Canonical SMILES | C1CN(CC1C2=NC3=C(N2)C=C(C=C3)C#N)CC4=CC=C(C=C4)F |
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Other Names | NAT31-457738 |