| SpectraBase Spectrum ID |
Lt9VVsK5sC7 |
| Name |
(E-Z)-1'-Cyclododecen-1-yl-ethane-1,2-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.193280075 u |
| Formula |
C14H26O2 |
| InChI |
InChI=1S/C14H26O2/c15-12-14(16)13-10-8-6-4-2-1-3-5-7-9-11-13/h10,14-16H,1-9,11-12H2/b13-10+ |
| InChIKey |
SZLATOQHXDPRBU-JLHYYAGUSA-N |
| Molecular Weight |
226.360 g/mol |
| SMILES |
C1\C=C/(CCCCCCCCC1)C(O)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933656 |