| SpectraBase Spectrum ID |
3HASAmSxPd0 |
| Name |
(1S,2R,3R)-3-(4-Bromo-phenyl)-2-(4-chloro-phenyl)-1,2-dicyano-cyclopropanecarboxylic acid ethyl ester |
| Alternate Name(s) |
Ethyl 3-(4-Bromophenyl)-2-(4-chlorophenyl)-1,2-dicyanocyclopropanecarboxylate isomer
(1S,2R,3R)-3-(4-bromophenyl)-2-(4-chlorophenyl)-1,2-dicyano-1-cyclopropanecarboxylic acid ethyl ester
ethyl (1S,2R,3R)-3-(4-bromophenyl)-2-(4-chlorophenyl)-1,2-dicyanocyclopropane-1-carboxylate
ethyl (1S,2R,3R)-3-(4-bromophenyl)-2-(4-chlorophenyl)-1,2-dicyano-cyclopropanecarboxylate
ethyl (1S,2R,3R)-3-(4-bromophenyl)-2-(4-chlorophenyl)-1,2-dicyano-cyclopropane-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H14BrClN2O2 |
| InChI |
InChI=1S/C20H14BrClN2O2/c1-2-26-18(25)20(12-24)17(13-3-7-15(21)8-4-13)19(20,11-23)14-5-9-16(22)10-6-14/h3-10,17H,2H2,1H3/t17-,19-,20-/m1/s1 |
| InChIKey |
RMVWKWVJQWZLON-MISYRCLQSA-N |
| Molecular Weight |
429.701 g/mol |
| SMILES |
[C@@]1([C@](C#N)(c2ccc(cc2)Cl)[C@]1(c1ccc(cc1)Br)[H])(C(=O)OCC)C#N |
| SPLASH |
splash10-003r-0000900000-813582d6a9ed962a206f |
| Source of Spectrum |
U1-2010-1986-5c' |
| Wiley ID |
1663510 |
