| SpectraBase Spectrum ID |
146x6oJ25w |
| Name |
(E)-methyl 2-(5-(benzyloxy)-5-oxopent-2-en-3-yl)-1-(pyrimidin-2-yl)-1H-indole-5-carboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
441.168856229 u |
| Formula |
C26H23N3O4 |
| InChI |
InChI=1S/C26H23N3O4/c1-3-19(16-24(30)33-17-18-8-5-4-6-9-18)23-15-21-14-20(25(31)32-2)10-11-22(21)29(23)26-27-12-7-13-28-26/h3-15H,16-17H2,1-2H3/b19-3+ |
| InChIKey |
JEEWAMRLGDLZQJ-QBROUFQSSA-N |
| Instrument Name |
Finnigan MAT SSQ 700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201704682 |
| Molecular Weight |
441.487 g/mol |
| Reported Formula |
C26H23N3O4 |
| SMILES |
COC(=O)C1=CC2=C(C=C1)N(C(=C2)\C(=C\C)CC(=O)OCC1=CC=CC=C1)C1=NC=CC=N1 |
| SPLASH |
splash10-054o-0004900000-026b0ff146114d7017a4 |
| Source of Spectrum |
ACI-56-SM8-3k (DOI: 10.1002/anie.201704682) |
| Wiley ID |
1896239 |
