| SpectraBase Compound ID | FHnBLNFunzz |
|---|---|
| InChI | InChI=1S/C27H28N2O3/c1-3-19-18-29(27(31)21-7-5-4-6-8-21)16-14-20(19)9-12-26(30)23-13-15-28-25-11-10-22(32-2)17-24(23)25/h3-8,10-11,13,15,17,19-20H,1,9,12,14,16,18H2,2H3/t19-,20+/m0/s1 |
| InChIKey | ZICFJNSJMAXLKZ-VQTJNVASSA-N |
| Mol Weight | 428.53 g/mol |
| Molecular Formula | C27H28N2O3 |
| Exact Mass | 428.209993 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8mUzKG5CWbh |
|---|---|
| Name | N-benzoylquinotoxine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H28N2O3 |
| InChI | InChI=1S/C27H28N2O3/c1-3-19-18-29(27(31)21-7-5-4-6-8-21)16-14-20(19)9-12-26(30)23-13-15-28-25-11-10-22(32-2)17-24(23)25/h3-8,10-11,13,15,17,19-20H,1,9,12,14,16,18H2,2H3/t19-,20+/m0/s1 |
| InChIKey | ZICFJNSJMAXLKZ-VQTJNVASSA-N |
| Literature Reference DOI | 10.1002/hlca.19730560505 |
| Molecular Weight | 428.532 g/mol |
| SMILES | c1(ccc2c(c1)c(ccn2)C(CC[C@@]1(CCN(C[C@@]1(C=C)[H])C(c1ccccc1)=O)[H])=O)OC |
| SPLASH | splash10-0a6r-3910000000-31877014d63236ab94fc |
| Source of Spectrum | H-56-1493-17 |
| Synonyms | 3-((3R,4R)-1-benzoyl-3-vinylpiperidin-4-yl)-1-(6-methoxyquinolin-4-yl)propan-1-one |
| Wiley ID | 1801417 |