| SpectraBase Spectrum ID |
7X4EEZHpLnX |
| Name |
(2R,4S)-2-(4-chlorophenyl)-4-(4-methoxyphenyl)-1-methyl-1,2,3,4-tetrahydroquinoline |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.138992031 u |
| Formula |
C23H22ClNO |
| InChI |
InChI=1S/C23H22ClNO/c1-25-22-6-4-3-5-20(22)21(16-9-13-19(26-2)14-10-16)15-23(25)17-7-11-18(24)12-8-17/h3-14,21,23H,15H2,1-2H3/t21-,23+/m0/s1 |
| InChIKey |
XJTHMWNEQGBKPS-JTHBVZDNSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201800677 |
| Molecular Weight |
363.888 g/mol |
| Optical Rotation |
[a]D(RT) = +28.0 (c = 1.0, CH2Cl2) |
| Quality |
59 |
| SMILES |
C1(Cl)=CC=C(C=C1)[C@@]1(N(C2=C([C@@](C1)(C1=CC=C(C=C1)OC)[H])C=CC=C2)C)[H] |
| SPLASH |
splash10-03dr-0139000000-8a2ad6847871993cf005 |
| Sample Comments |
96% ee |
| Source of Spectrum |
QE-24-SM7-3l (DOI: 10.1002/chem.201800677) |
| Wiley ID |
1901512 |
