| SpectraBase Compound ID | C05JVrMCXJQ |
|---|---|
| InChI | InChI=1S/C19H22S/c1-19(2,18(20)17-13-7-4-8-14-17)15-9-12-16-10-5-3-6-11-16/h3-8,10-11,13-14H,9,12,15H2,1-2H3 |
| InChIKey | MCTNEBBFENKGQE-UHFFFAOYSA-N |
| Mol Weight | 282.44 g/mol |
| Molecular Formula | C19H22S |
| Exact Mass | 282.144222 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LVVOLdDpHVV |
|---|---|
| Name | 1-Pentanethione, 2,2-dimethyl-1,5-diphenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.144221882 u |
| Formula | C19H22S |
| InChI | InChI=1S/C19H22S/c1-19(2,18(20)17-13-7-4-8-14-17)15-9-12-16-10-5-3-6-11-16/h3-8,10-11,13-14H,9,12,15H2,1-2H3 |
| InChIKey | MCTNEBBFENKGQE-UHFFFAOYSA-N |
| SMILES | C(C(CCCC1=CC=CC=C1)(C)C)(=S)C=1C=CC=CC1 |