| SpectraBase Spectrum ID |
Jyxxk5Ybv6X |
| Name |
(E)-3-(4'-Chlorostyryl)pentane-2,4-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13ClO2 |
| InChI |
InChI=1S/C13H13ClO2/c1-9(15)13(10(2)16)8-5-11-3-6-12(14)7-4-11/h3-8,13H,1-2H3/b8-5+ |
| InChIKey |
GRVOLMCNJIGBLW-VMPITWQZSA-N |
| Molecular Weight |
236.698 g/mol |
| SMILES |
CC(C(C(C)=O)\C=C\c1ccc(cc1)Cl)=O |
| SPLASH |
splash10-000i-0090000000-e74dd8db28b8260f343a |
| Source of Spectrum |
D1-2006-1722-0 |
| Synonyms |
3-[(E)-2-(4-chlorophenyl)ethenyl]-2,4-pentanedione |
| Wiley ID |
1614118 |
