SpectraBase Spectrum ID |
9z1kbFn48Y4 |
Name |
(E)-2,2,9,9-Tetramethyldec-5-ene-3,8-diol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
228.208930140 u |
Formula |
C14H28O2 |
InChI |
InChI=1S/C14H28O2/c1-13(2,3)11(15)9-7-8-10-12(16)14(4,5)6/h7-8,11-12,15-16H,9-10H2,1-6H3/b8-7+ |
InChIKey |
CWOXCUHSVCLEOT-BQYQJAHWSA-N |
Molecular Weight |
228.376 g/mol |
SMILES |
C(C(O)C\C=C\CC(C(C)(C)C)O)(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976165 |