| SpectraBase Compound ID | 253XrR1j3Je |
|---|---|
| InChI | InChI=1S/C26H41NO6/c1-6-27-12-24(13-30-3)8-7-20(32-5)26-16-9-15-18(31-4)11-25(29,17(23(26)27)10-19(24)26)21(16)22(15)33-14(2)28/h15-23,29H,6-13H2,1-5H3/t15-,16?,17-,18+,19+,20?,21+,22?,23+,24-,25+,26+/m0/s1 |
| InChIKey | ZHYCSYOPFIUANO-RWBRSYDPSA-N |
| Mol Weight | 463.6 g/mol |
| Molecular Formula | C26H41NO6 |
| Exact Mass | 463.293388 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FKWpEEt4it |
|---|---|
| Name | 20-ethyl-8-hydroxy-1,16-dimethoxy-4-(methoxymethyl)aconitan-14-yl acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H41NO6 |
| InChI | InChI=1S/C26H41NO6/c1-6-27-12-24(13-30-3)8-7-20(32-5)26-16-9-15-18(31-4)11-25(29,17(23(26)27)10-19(24)26)21(16)22(15)33-14(2)28/h15-23,29H,6-13H2,1-5H3/t15-,16?,17-,18+,19+,20?,21+,22?,23+,24-,25+,26+/m0/s1 |
| InChIKey | ZHYCSYOPFIUANO-RWBRSYDPSA-N |
| Molecular Weight | 463.615 g/mol |
| SMILES | O[C@@]12[C@@]3(C([C@]45[C@]6([C@@]1(C[C@@]5([C@@](CN6CC)(COC)CCC4OC)[H])[H])[H])C[C@@]([C@](OC)(C2)[H])(C3OC(=O)C)[H])[H] |
| SPLASH | splash10-001i-3200900000-f252ba3462adcaef6212 |
| Source of Spectrum | CD-282-0-0 |
| Wiley ID | 1391320 |