| SpectraBase Compound ID | 4l45D086tFY |
|---|---|
| InChI | InChI=1S/C13H17ClO6/c1-6(15)19-10-8-3-4-17-12-9(8)13(5-18-12,11(10)14)20-7(2)16/h8-12H,3-5H2,1-2H3/t8?,9?,10-,11+,12+,13+/m0/s1 |
| InChIKey | WEOZERNFJKICLD-KUHWMHPDSA-N |
| Mol Weight | 304.73 g/mol |
| Molecular Formula | C13H17ClO6 |
| Exact Mass | 304.071366 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LeRzbzNiajC |
|---|---|
| Name | REHMAGLUTIN_D_DIACETATE |
| Compound Number | 314 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H17ClO6 |
| InChI | InChI=1S/C13H17ClO6/c1-6(15)19-10-8-3-4-17-12-9(8)13(5-18-12,11(10)14)20-7(2)16/h8-12H,3-5H2,1-2H3/t8?,9?,10-,11+,12+,13+/m0/s1 |
| InChIKey | WEOZERNFJKICLD-KUHWMHPDSA-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 | 304.727 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ16277 |