| SpectraBase Compound ID | 7CZ7B9xlsUC |
|---|---|
| InChI | InChI=1S/C26H38N4O5/c1-7-15(3)22-25(33)27-12-11-18-9-10-21(35-6)19(13-18)14-20(28-17(5)31)24(32)29-23(16(4)8-2)26(34)30-22/h9-13,15-16,20,22-23H,7-8,14H2,1-6H3,(H,27,33)(H,28,31)(H,29,32)(H,30,34)/b12-11-/i5D3 |
| InChIKey | ZPCYPMSYCMXGML-HMUQLHBMSA-N |
| Mol Weight | 489.6 g/mol |
| Molecular Formula | C26H352D3N4O5 |
| Exact Mass | 489.303051 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | D3U7P0ozIwU |
|---|---|
| Name | N-trideuterioacetylabyssenin-C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H35D3N4O5 |
| InChI | InChI=1S/C26H38N4O5/c1-7-15(3)22-25(33)27-12-11-18-9-10-21(35-6)19(13-18)14-20(28-17(5)31)24(32)29-23(16(4)8-2)26(34)30-22/h9-13,15-16,20,22-23H,7-8,14H2,1-6H3,(H,27,33)(H,28,31)(H,29,32)(H,30,34)/b12-11-/i5D3 |
| InChIKey | ZPCYPMSYCMXGML-HMUQLHBMSA-N |
| Molecular Weight | 489.631 g/mol |
| SMILES | N1C(C(N\C=C/c2cc(CC(C(NC(C1=O)C(CC)C)=O)NC(C([2D])([2D])[2D])=O)c(OC)cc2)=O)C(CC)C |
| SPLASH | splash10-000i-5894800000-0245a1ac348356613ce9 |
| Source of Spectrum | U-74-1920-22 |
| Wiley ID | 1396478 |