| SpectraBase Compound ID | 7N8EJQn89d4 |
|---|---|
| InChI | InChI=1S/C18H32O4/c1-2-3-4-9-12-15(19)18-16(22-18)13-10-7-5-6-8-11-14-17(20)21/h16,18H,2-14H2,1H3,(H,20,21) |
| InChIKey | UMXHXBIKJIORIB-UHFFFAOYSA-N |
| Mol Weight | 312.4 g/mol |
| Molecular Formula | C18H32O4 |
| Exact Mass | 312.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L0LpBWE8pcF |
|---|---|
| Name | 10,11-Epoxy-12-oxooctadecanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.230059506 u |
| Formula | C18H32O4 |
| InChI | InChI=1S/C18H32O4/c1-2-3-4-9-12-15(19)18-16(22-18)13-10-7-5-6-8-11-14-17(20)21/h16,18H,2-14H2,1H3,(H,20,21) |
| InChIKey | UMXHXBIKJIORIB-UHFFFAOYSA-N |
| SMILES | OC(CCCCCCCCC1C(C(CCCCCC)=O)O1)=O |