SpectraBase Spectrum ID |
24Zq4J4zPDr |
Name |
Chloroacetamide, N-(2-phenylethyl)-N-ethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
225.092041838 u |
Formula |
C12H16ClNO |
InChI |
InChI=1S/C12H16ClNO/c1-2-14(12(15)10-13)9-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3 |
InChIKey |
CHEWTPOEYHIESF-UHFFFAOYSA-N |
Molecular Weight |
225.719 g/mol |
SMILES |
C1=CC=CC(=C1)CCN(C(CCl)=O)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894524 |