![7,17-bis(p-tolylsulfonyl)-2,2-dimethyl-4,6,7,8,9,10,11,12,13,14,15,16,17,18-tetradecahydro-19,5(nitrilometheno)-1,3-dioxino[4,5-d][1,8]diazacycloheptadecine](/api/spectrum/DO3e8IaXABm/structure.png?h=300&w=458 "7,17-bis(p-tolylsulfonyl)-2,2-dimethyl-4,6,7,8,9,10,11,12,13,14,15,16,17,18-tetradecahydro-19,5(nitrilometheno)-1,3-dioxino[4,5-d][1,8]diazacycloheptadecine")
| SpectraBase Compound ID | 5i6B2HX05OC |
|---|---|
| InChI | InChI=1S/C34H45N3O6S2/c1-26-12-16-29(17-13-26)44(38,39)36-20-10-8-6-5-7-9-11-21-37(45(40,41)30-18-14-27(2)15-19-30)24-32-33-31(28(23-36)22-35-32)25-42-34(3,4)43-33/h12-19,22H,5-11,20-21,23-25H2,1-4H3 |
| InChIKey | YTHBWZLPISQUOY-UHFFFAOYSA-N |
| Mol Weight | 655.9 g/mol |
| Molecular Formula | C34H45N3O6S2 |
| Exact Mass | 655.274979 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DO3e8IaXABm |
|---|---|
| Name | 7,17-bis(p-tolylsulfonyl)-2,2-dimethyl-4,6,7,8,9,10,11,12,13,14,15,16,17,18-tetradecahydro-19,5(nitrilometheno)-1,3-dioxino[4,5-d][1,8]diazacycloheptadecine |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H45N3O6S2 |
| InChI | InChI=1S/C34H45N3O6S2/c1-26-12-16-29(17-13-26)44(38,39)36-20-10-8-6-5-7-9-11-21-37(45(40,41)30-18-14-27(2)15-19-30)24-32-33-31(28(23-36)22-35-32)25-42-34(3,4)43-33/h12-19,22H,5-11,20-21,23-25H2,1-4H3 |
| InChIKey | YTHBWZLPISQUOY-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 41526M |
| Solvent | CDCl3 |