| SpectraBase Spectrum ID |
ICqd0pkAlWP |
| Name |
(5E)-6,10-Dimethyl-3-propyl-undeca-1,5,9-triene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.219100902 u |
| Formula |
C16H28 |
| InChI |
InChI=1S/C16H28/c1-6-9-16(7-2)13-12-15(5)11-8-10-14(3)4/h7,10,12,16H,2,6,8-9,11,13H2,1,3-5H3/b15-12+ |
| InChIKey |
MUSPKYMTMRDMHF-NTCAYCPXSA-N |
| Molecular Weight |
220.400 g/mol |
| SMILES |
CC(=CCC\C(=C\CC(CCC)C=C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919182 |
