SpectraBase Spectrum ID |
50fgHD35Zw0 |
Name |
Benzamide, 2-chloro-N-(2-butyl)-N-methyl- |
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/c1-4-9(2)14(3)12(15)10-7-5-6-8-11(10)13/h5-9H,4H2,1-3H3 |
InChIKey |
GGWHSBRWIGUUNQ-UHFFFAOYSA-N |
Molecular Weight |
225.719 g/mol |
SMILES |
C(N(C)C(CC)C)(=O)C=1C(Cl)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872357 |