| SpectraBase Compound ID | ENtaUiuZEnk |
|---|---|
| InChI | InChI=1S/C36H54O6/c1-22(37)40-21-34(8)28-13-14-36(10)29(33(28,7)20-27(41-23(2)38)30(34)42-24(3)39)12-11-25-26-19-31(4,5)15-16-32(26,6)17-18-35(25,36)9/h11,13,26-27,29-30H,12,14-21H2,1-10H3/t26-,27-,29+,30-,32?,33?,34-,35?,36?/m0/s1 |
| InChIKey | MZLAOPRGGDUJLU-IZQIKZPBSA-N |
| Mol Weight | 582.8 g/mol |
| Molecular Formula | C36H54O6 |
| Exact Mass | 582.392039 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EKDtaqIKXcx |
|---|---|
| Name | TRIACETOXY-BUTYRACEOL |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H54O6 |
| InChI | InChI=1S/C36H54O6/c1-22(37)40-21-34(8)28-13-14-36(10)29(33(28,7)20-27(41-23(2)38)30(34)42-24(3)39)12-11-25-26-19-31(4,5)15-16-32(26,6)17-18-35(25,36)9/h11,13,26-27,29-30H,12,14-21H2,1-10H3/t26-,27-,29+,30-,32?,33?,34-,35?,36?/m0/s1 |
| InChIKey | MZLAOPRGGDUJLU-IZQIKZPBSA-N |
| Literature Reference Author | G.MISRA,R.BANERJI,S.K.NIGAM |
| Literature Reference Citation | PHYTOCHEM.,30,2087(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)85076-C |
| Molecular Weight | 582.821 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU34395 |