| SpectraBase Compound ID | HzIuSTX7Cyl |
|---|---|
| InChI | InChI=1S/C18H30O4/c1-20-17(19)13-9-7-5-3-2-4-6-8-11-15-21-18-14-10-12-16-22-18/h18H,2-4,6,8-16H2,1H3 |
| InChIKey | GCSSJUMWZKRWTL-UHFFFAOYSA-N |
| Mol Weight | 310.43 g/mol |
| Molecular Formula | C18H30O4 |
| Exact Mass | 310.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3nZNemeim9b |
|---|---|
| Name | Methyl 12-(tetrahydro-2-pyranyloxy)-4-dodecynoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.214409442 u |
| Formula | C18H30O4 |
| InChI | InChI=1S/C18H30O4/c1-20-17(19)13-9-7-5-3-2-4-6-8-11-15-21-18-14-10-12-16-22-18/h18H,2-4,6,8-16H2,1H3 |
| InChIKey | GCSSJUMWZKRWTL-UHFFFAOYSA-N |
| SMILES | C1COC(CC1)OCCCCCCCC#CCCC(OC)=O |