| SpectraBase Compound ID | KJ9xp0ebwwZ |
|---|---|
| InChI | InChI=1S/C20H26O5/c1-12-10-14-16-18(2,7-5-15(21)19(16,3)17(22)25-14)20(12,23)8-4-13-6-9-24-11-13/h6,9,11-12,14,16,23H,4-5,7-8,10H2,1-3H3/t12-,14-,16-,18+,19+,20-/m1/s1 |
| InChIKey | NMTGXAKMAWZRIF-YCXIAQJUSA-N |
| Mol Weight | 346.42 g/mol |
| Molecular Formula | C20H26O5 |
| Exact Mass | 346.178024 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F2LWvKLUxz2 |
|---|---|
| Name | PEREGRINONE;3-OXOMARRUBIIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H26O5 |
| InChI | InChI=1S/C20H26O5/c1-12-10-14-16-18(2,7-5-15(21)19(16,3)17(22)25-14)20(12,23)8-4-13-6-9-24-11-13/h6,9,11-12,14,16,23H,4-5,7-8,10H2,1-3H3/t12-,14-,16-,18+,19+,20-/m1/s1 |
| InChIKey | NMTGXAKMAWZRIF-YCXIAQJUSA-N |
| Literature Reference Author | A.T.KHALIL,S.R.GEDARA,M.F.LAHLOUB,A.F.HALIM |
| Literature Reference Citation | PHYTOCHEM.,41,1569(1996) |
| Literature Reference DOI | 10.1016/0031-9422(96)80827-2 |
| Molecular Weight | 346.423 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU4467 |