| SpectraBase Compound ID | FAj5ybC5g2D |
|---|---|
| InChI | InChI=1S/C16H16O2S/c1-11-5-4-6-13(9-11)19-15-10-12(2)7-8-14(15)16(17)18-3/h4-10H,1-3H3 |
| InChIKey | KBWLRWDSJFXFEY-UHFFFAOYSA-N |
| Mol Weight | 272.36 g/mol |
| Molecular Formula | C16H16O2S |
| Exact Mass | 272.087101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KFospXdz8bt |
|---|---|
| Name | Methyl 4-methyl-2-m-tolylsulfanylbenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H16O2S |
| InChI | InChI=1S/C16H16O2S/c1-11-5-4-6-13(9-11)19-15-10-12(2)7-8-14(15)16(17)18-3/h4-10H,1-3H3 |
| InChIKey | KBWLRWDSJFXFEY-UHFFFAOYSA-N |
| Molecular Weight | 272.362 g/mol |
| SMILES | c1(c(Sc2cc(C)ccc2)cc(cc1)C)C(=O)OC |
| SPLASH | splash10-006x-0090000000-f4112e90725f25f93c1b |
| Source of Spectrum | F4-41-302-5c |
| Wiley ID | 1671900 |