| SpectraBase Compound ID | 64pDiQEndTL |
|---|---|
| InChI | InChI=1S/C15H20O3/c1-11(2)4-7-13-10-12(5-8-14(13)16)6-9-15(17)18-3/h5,8,10,16H,1,4,6-7,9H2,2-3H3 |
| InChIKey | FWDCTKLTCWPELL-UHFFFAOYSA-N |
| Mol Weight | 248.32 g/mol |
| Molecular Formula | C15H20O3 |
| Exact Mass | 248.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2meZRfMacaJ |
|---|---|
| Name | Dihydroplicatin B |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.141244501 u |
| Formula | C15H20O3 |
| InChI | InChI=1S/C15H20O3/c1-11(2)4-7-13-10-12(5-8-14(13)16)6-9-15(17)18-3/h5,8,10,16H,1,4,6-7,9H2,2-3H3 |
| InChIKey | FWDCTKLTCWPELL-UHFFFAOYSA-N |
| Molecular Weight | 248.322 g/mol |
| SMILES | C=1(C(=CC=C(C1)CCC(=O)OC)O)CCC(=C)C |