| SpectraBase Compound ID | IEWU11XAOqh |
|---|---|
| InChI | InChI=1S/C21H29NO8S/c1-20(2)27-15-14(26-19-17(16(15)28-20)29-21(3,4)30-19)11-8-12-31(24,25)22-18(23)13-9-6-5-7-10-13/h5-7,9-10,14-17,19H,8,11-12H2,1-4H3,(H,22,23)/t14-,15+,16+,17-,19-/m0/s1 |
| InChIKey | YLYWSJMFJUTLDG-ATIFRJIPSA-N |
| Mol Weight | 455.52 g/mol |
| Molecular Formula | C21H29NO8S |
| Exact Mass | 455.161388 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7pO4w3XB8pi |
|---|---|
| Name | YLYWSJMFJUTLDG-ATIFRJIPSA-N |
| Compound Number | 7G |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H29NO8S |
| InChI | InChI=1S/C21H29NO8S/c1-20(2)27-15-14(26-19-17(16(15)28-20)29-21(3,4)30-19)11-8-12-31(24,25)22-18(23)13-9-6-5-7-10-13/h5-7,9-10,14-17,19H,8,11-12H2,1-4H3,(H,22,23)/t14-,15+,16+,17-,19-/m0/s1 |
| InChIKey | YLYWSJMFJUTLDG-ATIFRJIPSA-N |
| Literature Reference Author | S.CADDICK,J.D.WILDEN,H.D.BUSH,S.N.WADMAN,D.B.JUDD |
| Literature Reference Citation | ORG.LETTERS,4,2549(2002) |
| Literature Reference DOI | 10.1021/ol026181m |
| Molecular Weight | 455.523 g/mol |
| Sample ID | 28383 |
| Solvent | CDCl3 |