![Thiocyanic acid, alpha-[(p-tolylsulfonyl)methyl]benzyl ester](/api/spectrum/2jc6AyvIGqa/structure.png?h=300&w=458 "Thiocyanic acid, alpha-[(p-tolylsulfonyl)methyl]benzyl ester")
| SpectraBase Compound ID | 6sJWzyR45TR |
|---|---|
| InChI | InChI=1S/C16H15NO2S2/c1-13-7-9-15(10-8-13)21(18,19)11-16(20-12-17)14-5-3-2-4-6-14/h2-10,16H,11H2,1H3 |
| InChIKey | LYGIYIJZXPJYGQ-UHFFFAOYSA-N |
| Mol Weight | 317.42 g/mol |
| Molecular Formula | C16H15NO2S2 |
| Exact Mass | 317.054421 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2jc6AyvIGqa |
|---|---|
| Name | thiocyanic acid, alpha-[(p-tolylsulfonyl)methyl]benzyl ester |
| Copyright | Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H21NO2S2 |
| InChI | InChI=1S/C16H15NO2S2/c1-13-7-9-15(10-8-13)21(18,19)11-16(20-12-17)14-5-3-2-4-6-14/h2-10,16H,11H2,1H3 |
| InChIKey | LYGIYIJZXPJYGQ-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 24194M |
| Solvent | CDCl3 |