| SpectraBase Spectrum ID |
A2aGXilJPVM |
| Name |
(Z)-Dimethyl 2-{4-[2-(pyridin-2-yl)phenyl]but-2-en-1-yl}malonate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.147058156 u |
| Formula |
C20H21NO4 |
| InChI |
InChI=1S/C20H21NO4/c1-24-19(22)17(20(23)25-2)12-6-4-10-15-9-3-5-11-16(15)18-13-7-8-14-21-18/h3-9,11,13-14,17H,10,12H2,1-2H3/b6-4- |
| InChIKey |
MYFBWAAWVGRMDB-XQRVVYSFSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201601778 |
| Molecular Weight |
339.391 g/mol |
| Quality |
10 |
| Reported Formula |
C20H21NO4 |
| SMILES |
C1(C\C=C/CC(C(=O)OC)C(OC)=O)=CC=CC=C1C1=CC=CC=N1 |
| SPLASH |
splash10-0aor-0791000000-e2c74b1db2a9ddb834d3 |
| Source of Spectrum |
ACI-55-SM22-(Z)-5aa (DOI: 10.1002/anie.201601778) |
| Wiley ID |
1900950 |
![(Z)-Dimethyl 2-{4-[2-(pyridin-2-yl)phenyl]but-2-en-1-yl}malonate](/api/spectrum/A2aGXilJPVM/structure.png?h=300&w=458 "(Z)-Dimethyl 2-{4-[2-(pyridin-2-yl)phenyl]but-2-en-1-yl}malonate")
