| SpectraBase Spectrum ID |
BCDkF2AKPNb |
| Name |
(2R,3R,4S)-2,4-bis(4-methoxyphenyl)-1,3-dimethyl-1,2,3,4-tetrahydroquinoline |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.204179111 u |
| Formula |
C25H27NO2 |
| InChI |
InChI=1S/C25H27NO2/c1-17-24(18-9-13-20(27-3)14-10-18)22-7-5-6-8-23(22)26(2)25(17)19-11-15-21(28-4)16-12-19/h5-17,24-25H,1-4H3/t17-,24+,25-/m1/s1 |
| InChIKey |
WDGRCPHAXTVANG-HCOMASKESA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201800677 |
| Molecular Weight |
373.496 g/mol |
| Optical Rotation |
[a]D(RT) = -22.1 (c = 1.0, CH2Cl2) |
| SMILES |
COC1=CC=C(C=C1)[C@@]1(N(C2=C([C@@]([C@]1(C)[H])(C1=CC=C(OC)C=C1)[H])C=CC=C2)C)[H] |
| SPLASH |
splash10-00di-0049000000-42f93f0082d7c1399c61 |
| Sample Comments |
92% ee |
| Source of Spectrum |
QE-24-SM11-9a (DOI: 10.1002/chem.201800677) |
| Wiley ID |
1901522 |
