SpectraBase Compound ID | 8B8QdtO1HIC |
---|---|
InChI | InChI=1S/C10H12FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2 |
InChIKey | ZDCXMSDSTZZWAX-UHFFFAOYSA-N |
Mol Weight | 165.21 g/mol |
Molecular Formula | C10H12FN |
Exact Mass | 165.095378 g/mol |
SpectraBase Spectrum ID | 4zcHc3wWcjB |
---|---|
Name | 2-(p-Fluorophenyl)pyrrolidine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 165.095377553 u |
Formula | C10H12FN |
InChI | InChI=1S/C10H12FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2 |
InChIKey | ZDCXMSDSTZZWAX-UHFFFAOYSA-N |
Molecular Weight | 165.211 g/mol |
SMILES | N1C(CCC1)C1=CC=C(C=C1)F |
Spectrum/Structure Validation Score (Raman) | 0.934415 |