SpectraBase Spectrum ID |
HKgZSb4vFxO |
Name |
Propionamide, 2-bromo-N-propyl-N-(3-methylbutyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
263.088477331 u |
Formula |
C11H22BrNO |
InChI |
InChI=1S/C11H22BrNO/c1-5-7-13(8-6-9(2)3)11(14)10(4)12/h9-10H,5-8H2,1-4H3 |
InChIKey |
YZBIVLSNNIEDIN-UHFFFAOYSA-N |
Molecular Weight |
264.207 g/mol |
SMILES |
C(N(CCC(C)C)CCC)(=O)C(C)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950742 |