| SpectraBase Spectrum ID |
9yQr4PW3dur |
| Name |
(2R,3S)-1-acetyl-3-allyl-2-(3-bromophenyl)-2,3-dihydroquinolin-4(1H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H18BrNO2 |
| InChI |
InChI=1S/C20H18BrNO2/c1-3-7-17-19(14-8-6-9-15(21)12-14)22(13(2)23)18-11-5-4-10-16(18)20(17)24/h3-6,8-12,17,19H,1,7H2,2H3/t17-,19-/m0/s1 |
| InChIKey |
ANEIKFLPJLDGOK-HKUYNNGSSA-N |
| Instrument Name |
HRMS |
| Ionization Type |
EI |
| Molecular Weight |
384.273 g/mol |
| Optical Rotation |
[a]D20 = 87.3?? (c = 0.94, CHCl3) |
| Reported Formula |
C20H18BrNO2 |
| SMILES |
c1ccc2c(c1)C([C@]([C@@](N2C(=O)C)(c1cccc(c1)Br)[H])(CC=C)[H])=O |
| SPLASH |
splash10-0006-9001000000-0dc3ab9d6053600ef862 |
| Sample Comments |
91% ee |
| Source of Spectrum |
CN101723893A |
| Wiley ID |
1841625 |
