![2-[(E)-1,2-diphenylethenyl]-1,3-benzothiazole](/api/spectrum/J4psVXeB6Yk/structure.png?h=300&w=458 "2-[(E)-1,2-diphenylethenyl]-1,3-benzothiazole")
| SpectraBase Compound ID | OWtR1mr2uQ |
|---|---|
| InChI | InChI=1S/C21H15NS/c1-3-9-16(10-4-1)15-18(17-11-5-2-6-12-17)21-22-19-13-7-8-14-20(19)23-21/h1-15H/b18-15+ |
| InChIKey | XKMJBCWDOMPNEG-OBGWFSINSA-N |
| Mol Weight | 313.42 g/mol |
| Molecular Formula | C21H15NS |
| Exact Mass | 313.092521 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J4psVXeB6Yk |
|---|---|
| Name | 2-[(E)-1,2-Diphenylethenyl]-1,3-benzothiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.092520661 u |
| Formula | C21H15NS |
| InChI | InChI=1S/C21H15NS/c1-3-9-16(10-4-1)15-18(17-11-5-2-6-12-17)21-22-19-13-7-8-14-20(19)23-21/h1-15H/b18-15+ |
| InChIKey | XKMJBCWDOMPNEG-OBGWFSINSA-N |
| Molecular Weight | 313.418 g/mol |
| SMILES | C1(=NC2=CC=CC=C2S1)\C(=C\C1=CC=CC=C1)C=1C=CC=CC1 |