SpectraBase Spectrum ID |
LalaYSrQyje |
Name |
Cyclohexyl 4-bromo-2-ethoxybenzamide, N-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
339.083391950 u |
Formula |
C16H22BrNO2 |
InChI |
InChI=1S/C16H22BrNO2/c1-3-20-15-11-12(17)9-10-14(15)16(19)18(2)13-7-5-4-6-8-13/h9-11,13H,3-8H2,1-2H3 |
InChIKey |
WBBFPJQNBPCKHH-UHFFFAOYSA-N |
Molecular Weight |
340.261 g/mol |
SMILES |
C1(Br)=CC(=C(C=C1)C(=O)N(C1CCCCC1)C)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.853896 |