| SpectraBase Compound ID | BCi70KtHsed |
|---|---|
| InChI | InChI=1S/C26H27N3O/c1-2-18-17-29-15-13-20(18)16-24(29)25(28-26(30)19-8-4-3-5-9-19)22-12-14-27-23-11-7-6-10-21(22)23/h2-12,14,18,20,24-25H,1,13,15-17H2,(H,28,30)/t18?,20?,24-,25-/m1/s1 |
| InChIKey | LUDJVVHYLPTLOW-ZWYFGLTBSA-N |
| Mol Weight | 397.52 g/mol |
| Molecular Formula | C26H27N3O |
| Exact Mass | 397.215413 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EJYNaJm4qWC |
|---|---|
| Name | N-(9'-Deoxyepicinchonin-9'-yl)benzamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H27N3O |
| InChI | InChI=1S/C26H27N3O/c1-2-18-17-29-15-13-20(18)16-24(29)25(28-26(30)19-8-4-3-5-9-19)22-12-14-27-23-11-7-6-10-21(22)23/h2-12,14,18,20,24-25H,1,13,15-17H2,(H,28,30)/t18?,20?,24-,25-/m1/s1 |
| InChIKey | LUDJVVHYLPTLOW-ZWYFGLTBSA-N |
| Molecular Weight | 397.522 g/mol |
| SMILES | N([C@@]([C@@]1(N2CC(C=C)C(C1)CC2)[H])(c1c2c(ncc1)cccc2)[H])C(=O)c1ccccc1 |
| SPLASH | splash10-0a6r-1942000000-6e123a329472010c43da |
| Source of Spectrum | AN-106-82-9 |
| Wiley ID | 747645 |