SpectraBase Spectrum ID |
YKSBvUvV5z |
Name |
(2E,6E)-3,7-Dimethyl-2,6-decadiene-1,10-diol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
198.161979946 u |
Formula |
C12H22O2 |
InChI |
InChI=1S/C12H22O2/c1-11(7-4-9-13)5-3-6-12(2)8-10-14/h5,8,13-14H,3-4,6-7,9-10H2,1-2H3/b11-5+,12-8+ |
InChIKey |
IQBYHYQMBCWCQE-QAZZFAKDSA-N |
Molecular Weight |
198.306 g/mol |
SMILES |
C(\C=C\(CC\C=C\(CCCO)C)C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951805 |