| SpectraBase Compound ID | CeNtj6TmkDv |
|---|---|
| InChI | InChI=1S/C14H10S2/c1-2-6-11(7-3-1)10-14-15-12-8-4-5-9-13(12)16-14/h1-10H |
| InChIKey | OJXZBRHZZSLTQR-UHFFFAOYSA-N |
| Mol Weight | 242.35 g/mol |
| Molecular Formula | C14H10S2 |
| Exact Mass | 242.022393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7bLKZaHkmU1 |
|---|---|
| Name | 2-Benzylidene-1,3-benzodithiole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.022392670 u |
| Formula | C14H10S2 |
| InChI | InChI=1S/C14H10S2/c1-2-6-11(7-3-1)10-14-15-12-8-4-5-9-13(12)16-14/h1-10H |
| InChIKey | OJXZBRHZZSLTQR-UHFFFAOYSA-N |
| Molecular Weight | 242.354 g/mol |
| SMILES | C=1C=CC2=C(C1)SC(S2)=CC1=CC=CC=C1 |