SpectraBase Spectrum ID |
JyYHZeZrtYE |
Name |
Hexanamide, 3,5,5-trimethyl-N-heptyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
255.256214686 u |
Formula |
C16H33NO |
InChI |
InChI=1S/C16H33NO/c1-6-7-8-9-10-11-17-15(18)12-14(2)13-16(3,4)5/h14H,6-13H2,1-5H3,(H,17,18) |
InChIKey |
KXWQLYPAOLCPMU-UHFFFAOYSA-N |
Molecular Weight |
255.446 g/mol |
SMILES |
C(=O)(NCCCCCCC)CC(CC(C)(C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9666 |