| SpectraBase Compound ID | JRWclOGOYPK |
|---|---|
| InChI | InChI=1S/C18H16S/c1-2-7-15(8-3-1)13-19-14-17-11-6-10-16-9-4-5-12-18(16)17/h1-12H,13-14H2 |
| InChIKey | TUNMJEYFRLUWTB-UHFFFAOYSA-N |
| Mol Weight | 264.39 g/mol |
| Molecular Formula | C18H16S |
| Exact Mass | 264.097272 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BaRIIVzpGfe |
|---|---|
| Name | Benzyl-1-naphthylmethyl sulfide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.097271689 u |
| Formula | C18H16S |
| InChI | InChI=1S/C18H16S/c1-2-7-15(8-3-1)13-19-14-17-11-6-10-16-9-4-5-12-18(16)17/h1-12H,13-14H2 |
| InChIKey | TUNMJEYFRLUWTB-UHFFFAOYSA-N |
| Molecular Weight | 264.386 g/mol |
| SMILES | C=12C=CC=CC1C=CC=C2CSCC=1C=CC=CC1 |