| SpectraBase Compound ID | 7tuppplKTRs |
|---|---|
| InChI | InChI=1S/C18H16O2S2/c1-19-14-5-3-13(4-6-14)17-11-12-18(22-17)21-16-9-7-15(20-2)8-10-16/h3-12H,1-2H3 |
| InChIKey | DJULIRVZDDSJQY-UHFFFAOYSA-N |
| Mol Weight | 328.44 g/mol |
| Molecular Formula | C18H16O2S2 |
| Exact Mass | 328.059172 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ja857lBzX9d |
|---|---|
| Name | Thiophene, 2-(4-methoxyphenyl)-5-(4-methoxyphenylthio)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.059172101 u |
| Formula | C18H16O2S2 |
| InChI | InChI=1S/C18H16O2S2/c1-19-14-5-3-13(4-6-14)17-11-12-18(22-17)21-16-9-7-15(20-2)8-10-16/h3-12H,1-2H3 |
| InChIKey | DJULIRVZDDSJQY-UHFFFAOYSA-N |
| Molecular Weight | 328.444 g/mol |
| SMILES | COC1=CC=C(SC=2SC(C3=CC=C(OC)C=C3)=CC2)C=C1 |