| SpectraBase Spectrum ID |
3wt1DJa5Z88 |
| Name |
(E)-Dimethyl 2-{4-[3-methyl-1-(pyridin-2-yl)-1H-indol-2-yl]but-2-en-1-yl}malonate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
392.173607257 u |
| Formula |
C23H24N2O4 |
| InChI |
InChI=1S/C23H24N2O4/c1-16-17-10-4-7-13-20(17)25(21-14-8-9-15-24-21)19(16)12-6-5-11-18(22(26)28-2)23(27)29-3/h4-10,13-15,18H,11-12H2,1-3H3/b6-5+ |
| InChIKey |
BPLKZYLLCLXARG-AATRIKPKSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201601778 |
| Molecular Weight |
392.455 g/mol |
| Reported Formula |
C23H24N2O4 |
| SMILES |
C1=CC2=C(C=C1)N(C(=C2C)C\C=C\CC(C(OC)=O)C(=O)OC)C1=NC=CC=C1 |
| SPLASH |
splash10-01x0-0091000000-fcca9edfdb5890ae293e |
| Source of Spectrum |
ACI-55-SM20-(E)-3ja (DOI: 10.1002/anie.201601778) |
| Wiley ID |
1900937 |
![(E)-Dimethyl 2-{4-[3-methyl-1-(pyridin-2-yl)-1H-indol-2-yl]but-2-en-1-yl}malonate](/api/spectrum/3wt1DJa5Z88/structure.png?h=300&w=458 "(E)-Dimethyl 2-{4-[3-methyl-1-(pyridin-2-yl)-1H-indol-2-yl]but-2-en-1-yl}malonate")
