| SpectraBase Compound ID | 9esR15br5NZ |
|---|---|
| InChI | InChI=1S/C19H14S/c1-3-10-18-14(6-1)8-5-9-15(18)12-17-13-16-7-2-4-11-19(16)20-17/h1-11,13H,12H2 |
| InChIKey | FDMJLFUHIGQNPM-UHFFFAOYSA-N |
| Mol Weight | 274.38 g/mol |
| Molecular Formula | C19H14S |
| Exact Mass | 274.081622 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L7r3wUKXKS9 |
|---|---|
| Name | 2-(1-Naphthalenylmethyl)-1-benzothiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.081621625 u |
| Formula | C19H14S |
| InChI | InChI=1S/C19H14S/c1-3-10-18-14(6-1)8-5-9-15(18)12-17-13-16-7-2-4-11-19(16)20-17/h1-11,13H,12H2 |
| InChIKey | FDMJLFUHIGQNPM-UHFFFAOYSA-N |
| SMILES | C=1(SC2=CC=CC=C2C1)CC1=C2C(C=CC=C2)=CC=C1 |