| SpectraBase Compound ID | 32qDd4w3pph |
|---|---|
| InChI | InChI=1S/C29H48N3O9PSSi/c1-17(2)32-15-20-23(24-26(37-20)39-29(38-24)11-9-10-12-29)41-42(32,43)40-19-13-22(31-14-18(3)25(33)30-27(31)34)36-21(19)16-35-44(7,8)28(4,5)6/h14,17,19-24,26H,9-13,15-16H2,1-8H3,(H,30,33,34)/t19-,20-,21+,22+,23+,24-,26-,42?/m1/s1 |
| InChIKey | MHMLQRZZMQBXPH-UMDUWMTGSA-N |
| Mol Weight | 673.8 g/mol |
| Molecular Formula | C29H48N3O9PSSi |
| Exact Mass | 673.261815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L5fTM6AvtBj |
|---|---|
| Name | MHMLQRZZMQBXPH-UMDUWMTGSA-N |
| Compound Number | 4S |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H48N3O9PSSi |
| InChI | InChI=1S/C29H48N3O9PSSi/c1-17(2)32-15-20-23(24-26(37-20)39-29(38-24)11-9-10-12-29)41-42(32,43)40-19-13-22(31-14-18(3)25(33)30-27(31)34)36-21(19)16-35-44(7,8)28(4,5)6/h14,17,19-24,26H,9-13,15-16H2,1-8H3,(H,30,33,34)/t19-,20-,21+,22+,23+,24-,26-,42?/m1/s1 |
| InChIKey | MHMLQRZZMQBXPH-UMDUWMTGSA-N |
| Literature Reference Author | Y.JIN,G.JUST |
| Literature Reference Citation | J.ORG.CHEM.,63,3647(1998) |
| Literature Reference DOI | 10.1021/jo972318o |
| Molecular Weight | 673.834 g/mol |
| Sample ID | 37263 |
| Solvent | CDCl3 |