SpectraBase Spectrum ID |
LXG9S6WNUgr |
Name |
Butyramide, 4-chloro-N-(2-butyl)-N-hexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
261.185942225 u |
Formula |
C14H28ClNO |
InChI |
InChI=1S/C14H28ClNO/c1-4-6-7-8-12-16(13(3)5-2)14(17)10-9-11-15/h13H,4-12H2,1-3H3 |
InChIKey |
HTZPZRXZCQDGIM-UHFFFAOYSA-N |
Molecular Weight |
261.837 g/mol |
SMILES |
C(N(CCCCCC)C(CC)C)(=O)CCCCl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.808071 |