| SpectraBase Compound ID | IvcHCJ6LfWr |
|---|---|
| InChI | InChI=1S/C26H33ClO10/c1-12-8-9-17(34-14(3)28)24(6)11-10-18(35-15(4)29)25(7,32)20(24)22(36-16(5)30)26(33)13(2)23(31)37-21(26)19(12)27/h8-11,13,17-22,32-33H,1H2,2-7H3/b9-8-/t13-,17+,18+,19-,20+,21-,22+,24+,25+,26-/m0/s1 |
| InChIKey | AGDFENFYSVKDGA-IYQIXORUSA-N |
| Mol Weight | 541.0 g/mol |
| Molecular Formula | C26H33ClO10 |
| Exact Mass | 540.176225 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BKQDGw6R2zS |
|---|---|
| Name | NUI-INOALIDE-D |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H33ClO10 |
| InChI | InChI=1S/C26H33ClO10/c1-12-8-9-17(34-14(3)28)24(6)11-10-18(35-15(4)29)25(7,32)20(24)22(36-16(5)30)26(33)13(2)23(31)37-21(26)19(12)27/h8-11,13,17-22,32-33H,1H2,2-7H3/b9-8-/t13-,17+,18+,19-,20+,21-,22+,24+,25+,26-/m0/s1 |
| InChIKey | AGDFENFYSVKDGA-IYQIXORUSA-N |
| Literature Reference Author | M.T.HAMANN,K.N.HARRISON,A.R.CARROLL,P.J.SCHEUER |
| Literature Reference Citation | HETEROCYCLES,42,325(1996) |
| Literature Reference DOI | 10.3987/COM-95-S39 |
| Molecular Weight | 540.995 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP6049 |