SpectraBase Spectrum ID |
ZoACoeAsSx |
Name |
2-(4-Chlorophenyl)-N-cyclopentylacetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
237.092041838 u |
Formula |
C13H16ClNO |
InChI |
InChI=1S/C13H16ClNO/c14-11-7-5-10(6-8-11)9-13(16)15-12-3-1-2-4-12/h5-8,12H,1-4,9H2,(H,15,16) |
InChIKey |
WGLIBPCZBACXFH-UHFFFAOYSA-N |
Molecular Weight |
237.730 g/mol |
SMILES |
C(CC1=CC=C(C=C1)Cl)(=O)NC1CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.810928 |