| SpectraBase Compound ID | 4sGclrmCEAY |
|---|---|
| InChI | InChI=1S/C19H16O3S/c1-21-16-7-3-13(4-8-16)18-11-15(20)12-19(23-18)14-5-9-17(22-2)10-6-14/h3-12H,1-2H3 |
| InChIKey | UAXGKFIFQXHHTG-UHFFFAOYSA-N |
| Mol Weight | 324.39 g/mol |
| Molecular Formula | C19H16O3S |
| Exact Mass | 324.082016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B7SCIAjzrNv |
|---|---|
| Name | 4H-Thiopyran-4-one, 2,6-bis(4-methoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.082015546 u |
| Formula | C19H16O3S |
| InChI | InChI=1S/C19H16O3S/c1-21-16-7-3-13(4-8-16)18-11-15(20)12-19(23-18)14-5-9-17(22-2)10-6-14/h3-12H,1-2H3 |
| InChIKey | UAXGKFIFQXHHTG-UHFFFAOYSA-N |
| Molecular Weight | 324.394 g/mol |
| SMILES | COC1=CC=C(C=C1)C1=CC(=O)C=C(S1)C1=CC=C(C=C1)OC |