![alpha-[(N-cyclohexyl-p-toluenesulfonamido)methyl]-1,3-dioxo- 2-isoindolinemalonic acid, diethyl ester](/api/spectrum/2p1GA0muaPW/structure.png?h=300&w=458 "alpha-[(N-cyclohexyl-p-toluenesulfonamido)methyl]-1,3-dioxo- 2-isoindolinemalonic acid, diethyl ester")
| SpectraBase Compound ID | 7D1AkHz1aVU |
|---|---|
| InChI | InChI=1S/C29H34N2O8S/c1-4-38-27(34)29(28(35)39-5-2,31-25(32)23-13-9-10-14-24(23)26(31)33)19-30(21-11-7-6-8-12-21)40(36,37)22-17-15-20(3)16-18-22/h9-10,13-18,21H,4-8,11-12,19H2,1-3H3 |
| InChIKey | CRFDKSFYBLLRCH-UHFFFAOYSA-N |
| Mol Weight | 570.7 g/mol |
| Molecular Formula | C29H34N2O8S |
| Exact Mass | 570.203587 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2p1GA0muaPW |
|---|---|
| Name | alpha-[(N-cyclohexyl-p-toluenesulfonamido)methyl]-1,3-dioxo- 2-isoindolinemalonic acid, diethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H34N2O8S |
| InChI | InChI=1S/C29H34N2O8S/c1-4-38-27(34)29(28(35)39-5-2,31-25(32)23-13-9-10-14-24(23)26(31)33)19-30(21-11-7-6-8-12-21)40(36,37)22-17-15-20(3)16-18-22/h9-10,13-18,21H,4-8,11-12,19H2,1-3H3 |
| InChIKey | CRFDKSFYBLLRCH-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 25785M |
| Solvent | CDCl3 |