| SpectraBase Compound ID | CxcyTQLPty8 |
|---|---|
| InChI | InChI=1S/C20H18O5/c1-24-17-11-16(12-3-7-14(21)8-4-12)20(25-2)19(23)18(17)13-5-9-15(22)10-6-13/h3-11,21-23H,1-2H3 |
| InChIKey | YNEMPXKRLPZFAX-UHFFFAOYSA-N |
| Mol Weight | 338.36 g/mol |
| Molecular Formula | C20H18O5 |
| Exact Mass | 338.115424 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9KtXH780xlS |
|---|---|
| Name | Terphenyllin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.115423675 u |
| Formula | C20H18O5 |
| InChI | InChI=1S/C20H18O5/c1-24-17-11-16(12-3-7-14(21)8-4-12)20(25-2)19(23)18(17)13-5-9-15(22)10-6-13/h3-11,21-23H,1-2H3 |
| InChIKey | YNEMPXKRLPZFAX-UHFFFAOYSA-N |
| Molecular Weight | 338.359 g/mol |
| SMILES | COC1=C(O)C(=C(OC)C=C1C=1C=CC(O)=CC1)C=1C=CC(O)=CC1 |