| SpectraBase Spectrum ID |
7OE9m2qAgjv |
| Name |
(2S)-3-[(1Z,5Z)-Trideca-1,5-dien-3-ynoxy]propane-1,2-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.188194694 u |
| Formula |
C16H26O3 |
| InChI |
InChI=1S/C16H26O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-19-15-16(18)14-17/h8-9,12-13,16-18H,2-7,14-15H2,1H3/b9-8-,13-12-/t16-/m0/s1 |
| InChIKey |
GTUVAFBOEGIOIW-BJQMMIFBSA-N |
| Molecular Weight |
266.381 g/mol |
| SMILES |
C(#C\C=C/CCCCCCC)\C=C/OC[C@@](O)(CO)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904466 |
![(2S)-3-[(1Z,5Z)-trideca-1,5-dien-3-ynoxy]propane-1,2-diol](/api/spectrum/7OE9m2qAgjv/structure.png?h=300&w=458 "(2S)-3-[(1Z,5Z)-trideca-1,5-dien-3-ynoxy]propane-1,2-diol")
