| SpectraBase Compound ID | DL7Kvmi7gFS |
|---|---|
| InChI | InChI=1S/C25H38O13/c1-6-11(2)22(31)38-23-18-15(7-17(29)25(18,5)32)14(9-33-23)10-34-24-21(36-13(4)28)20(35-12(3)27)19(30)16(8-26)37-24/h9,11,15-21,23-24,26,29-30,32H,6-8,10H2,1-5H3/t11?,15-,16+,17+,18-,19+,20-,21+,23+,24+,25-/m1/s1 |
| InChIKey | LDDUHYKAAYRTBL-IXJIVIOYSA-N |
| Mol Weight | 546.6 g/mol |
| Molecular Formula | C25H38O13 |
| Exact Mass | 546.231241 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | z2ep31OHhW |
|---|---|
| Name | 2',3'-DIACETYL-ISOVALEROSIDATE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H38O13 |
| InChI | InChI=1S/C25H38O13/c1-6-11(2)22(31)38-23-18-15(7-17(29)25(18,5)32)14(9-33-23)10-34-24-21(36-13(4)28)20(35-12(3)27)19(30)16(8-26)37-24/h9,11,15-21,23-24,26,29-30,32H,6-8,10H2,1-5H3/t11?,15-,16+,17+,18-,19+,20-,21+,23+,24+,25-/m1/s1 |
| InChIKey | LDDUHYKAAYRTBL-IXJIVIOYSA-N |
| Literature Reference Author | L.TOMASSINI,S.FODDAI,M.NICOLETTI,M.F.COMETA,G.PALAZZINO,C.GA LEFFI |
| Literature Reference Citation | PHYTOCHEM.,46,901(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)00379-8 |
| Molecular Weight | 546.569 g/mol |
| Sample ID | 52647 |
| Solvent | CD3OD |