| SpectraBase Compound ID | D9DTqg5Kh7H |
|---|---|
| InChI | InChI=1S/C31H42N4O6S3/c1-26-6-12-29(13-7-26)42(36,37)33-20-4-18-32-19-5-21-34(43(38,39)30-14-8-27(2)9-15-30)23-25-35(24-22-33)44(40,41)31-16-10-28(3)11-17-31/h6-17,32H,4-5,18-25H2,1-3H3 |
| InChIKey | KGUFEMBWGLWXSS-UHFFFAOYSA-N |
| Mol Weight | 662.9 g/mol |
| Molecular Formula | C31H42N4O6S3 |
| Exact Mass | 662.226649 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8rlikofEJoq |
|---|---|
| Name | 1,4,7-tris(p-tolylsulfonyl)-1,4,7,11-tetraazacyclotetradecane |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H42N4O6S3 |
| InChI | InChI=1S/C31H42N4O6S3/c1-26-6-12-29(13-7-26)42(36,37)33-20-4-18-32-19-5-21-34(43(38,39)30-14-8-27(2)9-15-30)23-25-35(24-22-33)44(40,41)31-16-10-28(3)11-17-31/h6-17,32H,4-5,18-25H2,1-3H3 |
| InChIKey | KGUFEMBWGLWXSS-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 32050M |
| Solvent | CDCl3 |