![2-{[m-(METHYLTHIO)PHENYL]CARBAMOYL}-alpha,alpha,3,5-TETRAMETHYLHYDROCINNAMIC ACID](/api/spectrum/7hcu8jSArit/structure.png?h=300&w=458 "2-{[m-(METHYLTHIO)PHENYL]CARBAMOYL}-alpha,alpha,3,5-TETRAMETHYLHYDROCINNAMIC ACID")
| SpectraBase Compound ID | H0EYc95ZCu6 |
|---|---|
| InChI | InChI=1S/C21H25NO3S/c1-13-9-14(2)18(15(10-13)12-21(3,4)20(24)25)19(23)22-16-7-6-8-17(11-16)26-5/h6-11H,12H2,1-5H3,(H,22,23)(H,24,25) |
| InChIKey | LKRRJDBAAOFMBM-UHFFFAOYSA-N |
| Mol Weight | 371.5 g/mol |
| Molecular Formula | C21H25NO3S |
| Exact Mass | 371.155515 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7hcu8jSArit |
|---|---|
| Name | 2-{[m-(methylthio)phenyl]carbamoyl}-a,a,3,5-tetramethylhydrocinnamic acid |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H25NO3S |
| InChI | InChI=1S/C21H25NO3S/c1-13-9-14(2)18(15(10-13)12-21(3,4)20(24)25)19(23)22-16-7-6-8-17(11-16)26-5/h6-11H,12H2,1-5H3,(H,22,23)(H,24,25) |
| InChIKey | LKRRJDBAAOFMBM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 30946M |
| Solvent | CDCl3 |