SpectraBase Spectrum ID |
LnDfVGBXzjM |
Name |
Dimethyl (E)-2-(4-chloro-1-phenylnon-3-en-2-yl)malonate |
Appearance |
Colorless thick oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
366.159787045 u |
Formula |
C20H27ClO4 |
InChI |
InChI=1S/C20H27ClO4/c1-4-5-7-12-17(21)14-16(13-15-10-8-6-9-11-15)18(19(22)24-2)20(23)25-3/h6,8-11,14,16,18H,4-5,7,12-13H2,1-3H3/b17-14+ |
InChIKey |
ZKRRZZAWBBLLHF-SAPNQHFASA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201803541 |
Molecular Weight |
366.885 g/mol |
Quality |
128 |
Reported Formula |
C20H27ClO4 |
SMILES |
COC(C(C(=O)OC)C(\C=C/(CCCCC)Cl)CC1=CC=CC=C1)=O |
SPLASH |
splash10-0006-9520000000-472d18ad25ccbf4efcd9 |
Source of Spectrum |
ACI-57-SM8-6b (DOI: 10.1002/anie.201803541) |
Wiley ID |
1893181 |