| SpectraBase Spectrum ID |
71eJgFCcbne |
| Name |
NK-104 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H22FNO3 |
| InChI |
InChI=1S/C25H22FNO3/c26-17-9-7-15(8-10-17)24-20-3-1-2-4-22(20)27-25(16-5-6-16)21(24)12-11-19-13-18(28)14-23(29)30-19/h1-4,7-12,16,18-19,28H,5-6,13-14H2/b12-11+ |
| InChIKey |
XJVKVAFYQRWVAJ-VAWYXSNFSA-N |
| Molecular Weight |
403.453 g/mol |
| SMILES |
OC1CC(OC(\C=C\c2c(nc3c(c2-c2ccc(cc2)F)cccc3)C2CC2)C1)=O |
| SPLASH |
splash10-000i-0090000000-a03e385d31cdb50029c2 |
| Source of Spectrum |
AT-33-7526-1 |
| Synonyms |
6-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]ethenyl]-4-hydroxy-2-oxanone
6-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]ethenyl]-4-hydroxyoxan-2-one
6-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]ethenyl]-4-oxidanyl-oxan-2-one |
| Wiley ID |
852327 |
