SpectraBase Spectrum ID |
JLMThxkjvSV |
Name |
(2E,6E,13E)-3,8,8,14,18-Pentamethyl-11-methylene-1-nonadeca-2,6,13,17-tetraenol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
358.323565971 u |
Formula |
C25H42O |
InChI |
InChI=1S/C25H42O/c1-21(2)11-10-13-22(3)14-15-24(5)16-19-25(6,7)18-9-8-12-23(4)17-20-26/h9,11,14,17-18,26H,5,8,10,12-13,15-16,19-20H2,1-4,6-7H3/b18-9+,22-14+,23-17+ |
InChIKey |
OIQGIUGCYRSAKT-MSMWCOSMSA-N |
Molecular Weight |
358.610 g/mol |
SMILES |
C(\C(=C\CC(=C)CCC(\C=C\CC\C(=C\CO)C)(C)C)C)CC=C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946457 |