![(2S)-3-[(1Z,5E)-13-methyltetradeca-1,5-dien-3-ynoxy]propane-1,2-diol](/api/spectrum/CzO8LJ5sgxt/structure.png?h=300&w=458 "(2S)-3-[(1Z,5E)-13-methyltetradeca-1,5-dien-3-ynoxy]propane-1,2-diol")
| SpectraBase Compound ID | C1Z1p8YcdB6 |
|---|---|
| InChI | InChI=1S/C18H30O3/c1-17(2)13-11-9-7-5-3-4-6-8-10-12-14-21-16-18(20)15-19/h4,6,12,14,17-20H,3,5,7,9,11,13,15-16H2,1-2H3/b6-4+,14-12-/t18-/m0/s1 |
| InChIKey | AAYSBNXVIDAGPI-QATGQJAQSA-N |
| Mol Weight | 294.43 g/mol |
| Molecular Formula | C18H30O3 |
| Exact Mass | 294.219495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CzO8LJ5sgxt |
|---|---|
| Name | (2S)-3-[(1Z,5E)-13-Methyltetradeca-1,5-dien-3-ynoxy]propane-1,2-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.219494823 u |
| Formula | C18H30O3 |
| InChI | InChI=1S/C18H30O3/c1-17(2)13-11-9-7-5-3-4-6-8-10-12-14-21-16-18(20)15-19/h4,6,12,14,17-20H,3,5,7,9,11,13,15-16H2,1-2H3/b6-4+,14-12-/t18-/m0/s1 |
| InChIKey | AAYSBNXVIDAGPI-QATGQJAQSA-N |
| SMILES | C(#C\C=C\CCCCCCC(C)C)\C=C/OC[C@@](O)(CO)[H] |