SpectraBase Spectrum ID |
LCn4zW92x21 |
Name |
N-[2-(2,2-Dichlorocyclopropyl)ethyl]-2,2-dimethylpropionamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
237.068719570 u |
Formula |
C10H17Cl2NO |
InChI |
InChI=1S/C10H17Cl2NO/c1-9(2,3)8(14)13-5-4-7-6-10(7,11)12/h7H,4-6H2,1-3H3,(H,13,14) |
InChIKey |
BUTNBGSCYPAOMS-UHFFFAOYSA-N |
Molecular Weight |
238.158 g/mol |
SMILES |
N(C(C(C)(C)C)=O)CCC1C(C1)(Cl)Cl |
Spectrum/Structure Validation Score (Raman) |
0.974657 |