| SpectraBase Compound ID | FacHnJdcTnz |
|---|---|
| InChI | InChI=1S/C28H43NO9/c1-7-29(33)12-26(13-34-4)9-8-19(32)28-17-10-16-18(35-5)11-27(38-15(3)31,20(17)22(16)37-14(2)30)21(25(28)29)23(36-6)24(26)28/h16-25,32H,7-13H2,1-6H3/t16?,17?,18-,19-,20?,21?,22-,23-,24?,25?,26-,27+,28?,29?/m0/s1 |
| InChIKey | DHYZXLPVVBAAMB-HRMSWAMUSA-N |
| Mol Weight | 537.7 g/mol |
| Molecular Formula | C28H43NO9 |
| Exact Mass | 537.293782 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8TPYGrEnPAY |
|---|---|
| Name | Delphisine - N-oxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H43NO9 |
| InChI | InChI=1S/C28H43NO9/c1-7-29(33)12-26(13-34-4)9-8-19(32)28-17-10-16-18(35-5)11-27(38-15(3)31,20(17)22(16)37-14(2)30)21(25(28)29)23(36-6)24(26)28/h16-25,32H,7-13H2,1-6H3/t16?,17?,18-,19-,20?,21?,22-,23-,24?,25?,26-,27+,28?,29?/m0/s1 |
| InChIKey | DHYZXLPVVBAAMB-HRMSWAMUSA-N |
| Molecular Weight | 537.650 g/mol |
| SMILES | O[C@@]1(C23C4C5[C@@](C6C3[N+](C[C@@](C2[C@]6(OC)[H])(CC1)COC)([O-])CC)(C[C@@](C([C@@]5(OC(=O)C)[H])C4)(OC)[H])OC(=O)C)[H] |
| SPLASH | splash10-0006-9000000000-4fb8c3179b2a83f40e4a |
| Source of Spectrum | G4-58-933-4 |
| Wiley ID | 1605939 |