| SpectraBase Spectrum ID |
BxdPd2fqEQb |
| Name |
6-chloro-2-(2-phenylprop-1-enylidene)hexanoic acid |
| Appearance |
solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H17ClO2 |
| InChI |
InChI=1S/C15H17ClO2/c1-12(13-7-3-2-4-8-13)11-14(15(17)18)9-5-6-10-16/h2-4,7-8H,5-6,9-10H2,1H3,(H,17,18) |
| InChIKey |
QMELFCWHGGFFLP-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Molecular Weight |
264.752 g/mol |
| Optical Rotation |
[a]D27 = -4.1 (c = 1.00, CHCl3) |
| SMILES |
OC(C(=C=C(c1ccccc1)C)CCCCCl)=O |
| SPLASH |
splash10-0006-0900000000-0cb95ec88942d7da7c85 |
| Sample Comments |
91% ee |
| Source of Spectrum |
CN111302928A |
| Wiley ID |
1877159 |
