SpectraBase Spectrum ID |
JnTj3PU1gmz |
Name |
Propionamide, 2-bromo-N-(2-butyl)-N-(2-ethylhexyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
319.151077589 u |
Formula |
C15H30BrNO |
InChI |
InChI=1S/C15H30BrNO/c1-6-9-10-14(8-3)11-17(12(4)7-2)15(18)13(5)16/h12-14H,6-11H2,1-5H3 |
InChIKey |
KSBOSKYJRBUJIZ-UHFFFAOYSA-N |
Molecular Weight |
320.315 g/mol |
SMILES |
C(N(CC(CCCC)CC)C(CC)C)(=O)C(C)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886668 |