SpectraBase Spectrum ID |
2wgbQ7mQBRT |
Name |
6-[(Z)-1',5'-Dimethyl-4'-hexenylidene]-5,9,13-trimethyl-4,8,12-tetradecatrien-1-ol |
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/c1-20(2)12-10-14-22(5)17-18-25(23(6)15-8-9-19-26)24(7)16-11-13-21(3)4/h12-13,15,17,26H,8-11,14,16,18-19H2,1-7H3/b22-17+,23-15+,25-24- |
InChIKey |
FFTGNIOMEIKFCU-QDJNLPPGSA-N |
Molecular Weight |
358.610 g/mol |
SMILES |
C(\C(\C(=C\CCCO)C)=C\(CCC=C(C)C)C)\C=C\(CCC=C(C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970579 |