| SpectraBase Compound ID | HXRrdzANWLu |
|---|---|
| InChI | InChI=1S/C27H29FN2O/c28-23-7-5-18(6-8-23)16-30-17-22(24-3-1-2-4-25(24)30)12-26(31)29-27-13-19-9-20(14-27)11-21(10-19)15-27/h1-8,17,19-21H,9-16H2,(H,29,31)/t19-,20+,21-,27- |
| InChIKey | UGPWISFILITTLX-PHWDIDRRSA-N |
| Mol Weight | 416.54 g/mol |
| Molecular Formula | C27H29FN2O |
| Exact Mass | 416.226392 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | F9WSliojKBU |
|---|---|
| Name | AFUBIATA |
| Catalog Number | 36992 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H29FN2O |
| InChI | InChI=1S/C27H29FN2O/c28-23-7-5-18(6-8-23)16-30-17-22(24-3-1-2-4-25(24)30)12-26(31)29-27-13-19-9-20(14-27)11-21(10-19)15-27/h1-8,17,19-21H,9-16H2,(H,29,31)/t19-,20+,21-,27- |
| InChIKey | UGPWISFILITTLX-PHWDIDRRSA-N |
| Molecular Weight | 416.540 g/mol |
| SMILES | N(C(=O)Cc1c[n](Cc2ccc(F)cc2)c2c1cccc2)C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H] |
| SPLASH | splash10-052r-3970000000-941673bba198ff809b11 |
| Source of Spectrum | CAY-2023-2158-0 |
| Wiley ID | 1890094 |