For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3'-Chloro-4'-fluoro-alpha-methyl-1-pyrrolidineacetanilide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

3'-Chloro-4'-fluoro-alpha-methyl-1-pyrrolidineacetanilide
SpectraBase Compound ID LCKhtssg8As
InChI InChI=1S/C13H16ClFN2O/c1-9(17-6-2-3-7-17)13(18)16-10-4-5-12(15)11(14)8-10/h4-5,8-9H,2-3,6-7H2,1H3,(H,16,18)
InChIKey PZEGGFHVDBZZPY-UHFFFAOYSA-N
Mol Weight 270.74 g/mol
Molecular Formula C13H16ClFN2O
Exact Mass 270.093519 g/mol

Raman Spectrum

Raman Spectrum

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID E5pVEIXd3oM
Name 3'-Chloro-4'-fluoro-alpha-methyl-1-pyrrolidineacetanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.093519005 u
Formula C13H16ClFN2O
InChI InChI=1S/C13H16ClFN2O/c1-9(17-6-2-3-7-17)13(18)16-10-4-5-12(15)11(14)8-10/h4-5,8-9H,2-3,6-7H2,1H3,(H,16,18)
InChIKey PZEGGFHVDBZZPY-UHFFFAOYSA-N
Molecular Weight 270.735 g/mol
SMILES N(C1=CC=C(C(=C1)Cl)F)C(C(N1CCCC1)C)=O
Spectrum/Structure Validation Score (Raman) 0.76685