| SpectraBase Compound ID | Cwrkcm2QcaJ |
|---|---|
| InChI | InChI=1S/C21H28O6/c1-9-6-13(26-5)19(25)21(4)11(9)7-14-20(3)12(8-15(22)27-14)10(2)16(23)17(24)18(20)21/h6,9-12,14,16,18,23H,7-8H2,1-5H3/t9-,10-,11+,12+,14-,16+,18+,20-,21+/m1/s1 |
| InChIKey | METCZOHMWLJDQD-NLHYBUFHSA-N |
| Mol Weight | 376.45 g/mol |
| Molecular Formula | C21H28O6 |
| Exact Mass | 376.188589 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Af2CxJ9A8Ud |
|---|---|
| Name | ISOPARAIN |
| Compound Number | 18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28O6 |
| InChI | InChI=1S/C21H28O6/c1-9-6-13(26-5)19(25)21(4)11(9)7-14-20(3)12(8-15(22)27-14)10(2)16(23)17(24)18(20)21/h6,9-12,14,16,18,23H,7-8H2,1-5H3/t9-,10-,11+,12+,14-,16+,18+,20-,21+/m1/s1 |
| InChIKey | METCZOHMWLJDQD-NLHYBUFHSA-N |
| Literature Reference Author | P.BARBETTI,G.GRANDOLINI,G.FARDELLA,I.CHIAPPINI |
| Literature Reference Citation | PHYTOCHEM.,32,1007(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85245-M |
| Molecular Weight | 376.450 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU6311 |