| SpectraBase Compound ID | Lno7S1GR8eP |
|---|---|
| InChI | InChI=1S/C29H44N4O7S/c1-8-10-22(29(37)40-7)30-26(34)23(17-18(2)3)31-27(35)24-11-9-16-33(24)28(36)25(19(4)5)32-41(38,39)21-14-12-20(6)13-15-21/h8,12-15,18-19,22-25,32H,1,9-11,16-17H2,2-7H3,(H,30,34)(H,31,35)/t22?,23-,24?,25+/m1/s1 |
| InChIKey | LJGLOLQKJHEIKE-DZIFKCOOSA-N |
| Mol Weight | 592.8 g/mol |
| Molecular Formula | C29H44N4O7S |
| Exact Mass | 592.293071 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GDaNByhAkjh |
|---|---|
| Name | LJGLOLQKJHEIKE-DZIFKCOOSA-N |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44N4O7S |
| InChI | InChI=1S/C29H44N4O7S/c1-8-10-22(29(37)40-7)30-26(34)23(17-18(2)3)31-27(35)24-11-9-16-33(24)28(36)25(19(4)5)32-41(38,39)21-14-12-20(6)13-15-21/h8,12-15,18-19,22-25,32H,1,9-11,16-17H2,2-7H3,(H,30,34)(H,31,35)/t22?,23-,24?,25+/m1/s1 |
| InChIKey | LJGLOLQKJHEIKE-DZIFKCOOSA-N |
| Literature Reference Author | U.KAZMAIER,S.MAIER |
| Literature Reference Citation | J.ORG.CHEM.,64,4574(1999) |
| Literature Reference DOI | 10.1021/jo9904821 |
| Molecular Weight | 592.751 g/mol |
| Sample ID | 57910 |
| Solvent | CDCl3 |