| SpectraBase Compound ID | 3s7w7l4iEKb |
|---|---|
| InChI | InChI=1S/C17H26N2O7S/c1-5-27-9-15-6-7-24-16(12(18)22,19-11(21)10(15)20)17(15,23)14(4)8-25-13(2,3)26-14/h23H,5-9H2,1-4H3,(H2,18,22)(H,19,21)/t14-,15-,16+,17-/m0/s1 |
| InChIKey | CALYCNJFEHRCKI-NXOAAHMSSA-N |
| Mol Weight | 402.46 g/mol |
| Molecular Formula | C17H26N2O7S |
| Exact Mass | 402.146072 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CbOqgKP56yM |
|---|---|
| Name | CALYCNJFEHRCKI-NXOAAHMSSA-N |
| Compound Number | 37 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H26N2O7S |
| InChI | InChI=1S/C17H26N2O7S/c1-5-27-9-15-6-7-24-16(12(18)22,19-11(21)10(15)20)17(15,23)14(4)8-25-13(2,3)26-14/h23H,5-9H2,1-4H3,(H2,18,22)(H,19,21)/t14-,15-,16+,17-/m0/s1 |
| InChIKey | CALYCNJFEHRCKI-NXOAAHMSSA-N |
| Literature Reference Author | Z.ZHANG,H.KOHN |
| Literature Reference Citation | J.AM.CHEM.SOC.,116,9815(1994) |
| Literature Reference DOI | 10.1021/ja00101a001 |
| Molecular Weight | 402.463 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI777 |