| SpectraBase Compound ID | 2tKQob5rElN |
|---|---|
| InChI | InChI=1S/C19H18O6/c1-21-12-10-13(22-2)17(23-3)18-14(12)15(20)19(24-4)16(25-18)11-8-6-5-7-9-11/h5-10H,1-4H3 |
| InChIKey | NTLVZMFGFHBJIJ-UHFFFAOYSA-N |
| Mol Weight | 342.35 g/mol |
| Molecular Formula | C19H18O6 |
| Exact Mass | 342.110338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1lfzFhwIXMG |
|---|---|
| Name | Gnaphaliin, 2me derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.110338294 u |
| Formula | C19H18O6 |
| InChI | InChI=1S/C19H18O6/c1-21-12-10-13(22-2)17(23-3)18-14(12)15(20)19(24-4)16(25-18)11-8-6-5-7-9-11/h5-10H,1-4H3 |
| InChIKey | NTLVZMFGFHBJIJ-UHFFFAOYSA-N |
| Molecular Weight | 342.347 g/mol |
| SMILES | C1(=C(C(=O)C2=C(C=C(C(=C2O1)OC)OC)OC)OC)C1=CC=CC=C1 |