| SpectraBase Spectrum ID |
AtXjc5DQjia |
| Name |
N,N'-bis-(7-chloro-3H-isobenzofuran-1-ylidene)-cyclohexane-(1R,2R)-diamine |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H20Cl2N2O2 |
| InChI |
InChI=1S/C22H20Cl2N2O2/c23-15-7-3-5-13-11-27-21(19(13)15)25-17-9-1-2-10-18(17)26-22-20-14(12-28-22)6-4-8-16(20)24/h3-8,17-18H,1-2,9-12H2/t17-,18-/m1/s1 |
| InChIKey |
QLMMWWSTEKNMNV-QZTJIDSGSA-N |
| Instrument Name |
??Hewlett-Packard 5988A |
| Ionization Type |
EI |
| Molecular Weight |
415.320 g/mol |
| Optical Rotation |
[a]D20 = -26.1 (c = 0.95, CHCl3) |
| SMILES |
[C@]1([C@@](CCCC1)(N=C1OCc2cccc(Cl)c12)[H])(N=C1c2c(Cl)cccc2CO1)[H] |
| SPLASH |
splash10-0fy9-3910000000-621563fe5ed04ce70865 |
| Source of Spectrum |
US2012077989A1 |
| Wiley ID |
1845090 |
