| SpectraBase Compound ID | DhvUDfORcoE |
|---|---|
| InChI | InChI=1S/C13H17ClO7/c1-5(15)19-10-7-3-8(17)20-12-9(7)13(4-18-12,11(10)14)21-6(2)16/h7-12,17H,3-4H2,1-2H3/t7?,8-,9?,10-,11+,12-,13+/m0/s1 |
| InChIKey | ROQUWXOXANLNMC-UVVWAOHHSA-N |
| Mol Weight | 320.73 g/mol |
| Molecular Formula | C13H17ClO7 |
| Exact Mass | 320.066281 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EuKLaOuvxBP |
|---|---|
| Name | REHMAGLUTIN_B_DIACETATE |
| Compound Number | 317 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H17ClO7 |
| InChI | InChI=1S/C13H17ClO7/c1-5(15)19-10-7-3-8(17)20-12-9(7)13(4-18-12,11(10)14)21-6(2)16/h7-12,17H,3-4H2,1-2H3/t7?,8-,9?,10-,11+,12-,13+/m0/s1 |
| InChIKey | ROQUWXOXANLNMC-UVVWAOHHSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 320.727 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ16281 |