SpectraBase Spectrum ID |
4yq1X8h5SGx |
Name |
Trans-3,7,11,15-tetramethyl-1,3-hexadecadiene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
278.297351224 u |
Formula |
C20H38 |
InChI |
InChI=1S/C20H38/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,12,17,19-20H,1,8-11,13-16H2,2-6H3/b18-12+ |
InChIKey |
HNTNJYMWJHGCBD-LDADJPATSA-N |
Molecular Weight |
278.524 g/mol |
SMILES |
CC(C)CCCC(C)CCCC(C)CC\C=C/(C)C=C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925721 |