SpectraBase Spectrum ID |
KGUWHqy9ph8 |
Name |
(S)-1-acetyl-2-(3-methoxyphenyl)-2,3-dihydroquinolin-4(1H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H17NO3 |
InChI |
InChI=1S/C18H17NO3/c1-12(20)19-16-9-4-3-8-15(16)18(21)11-17(19)13-6-5-7-14(10-13)22-2/h3-10,17H,11H2,1-2H3/t17-/m0/s1 |
InChIKey |
IJLKKDPFLRNXRQ-KRWDZBQOSA-N |
Instrument Name |
HRMS |
Ionization Type |
EI |
Molecular Weight |
295.338 g/mol |
Optical Rotation |
[a]D20 = -77.7?? (c = 0.56, CHCl3) |
Reported Formula |
C18H17NO3 |
SMILES |
c1ccc2c(c1)C(C[C@](N2C(=O)C)(c1cccc(c1)OC)[H])=O |
SPLASH |
splash10-0udj-3390000000-14adf96218988db51eb9 |
Sample Comments |
99% ee |
Source of Spectrum |
CN101723893A |
Wiley ID |
1841622 |