| SpectraBase Spectrum ID |
APt8DCnDXRf |
| Name |
(R/S)-Methyl-2-(1,3-dioxo-1H-pyrrolo[3,4-b]quinolin-2(3H)-yl)-3-phenylpropanoate |
| Appearance |
White solid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
360.111006999 u |
| Formula |
C21H16N2O4 |
| GC Oven Program |
Oven temp 320oC |
| InChI |
InChI=1S/C21H16N2O4/c1-27-21(26)17(11-13-7-3-2-4-8-13)23-19(24)15-12-14-9-5-6-10-16(14)22-18(15)20(23)25/h2-10,12,17H,11H2,1H3 |
| InChIKey |
GCZICGQVTIPHSX-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-2020 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202201374 |
| Molecular Weight |
360.369 g/mol |
| Quality |
141 |
| Reported Formula |
C21H16N2O4 |
| SMILES |
COC(C(CC1=CC=CC=C1)N1C(C2=NC=3C=CC=CC3C=C2C1=O)=O)=O |
| SPLASH |
splash10-03di-1849000000-b29e92c3f641dfc1c4fc |
| Source of Spectrum |
K1-26-SM8-3c (DOI: 10.1002/ejoc.202201374) |
| Thin-Layer Chromatography |
0.5 (n-Hexan/CHCl3/EtOAc, 60:20:20) |
| Wiley ID |
1910402 |
![(R/S)-Methyl-2-(1,3-dioxo-1H-pyrrolo[3,4-b]quinolin-2(3H)-yl)-3-phenylpropanoate](/api/spectrum/APt8DCnDXRf/structure.png?h=300&w=458 "(R/S)-Methyl-2-(1,3-dioxo-1H-pyrrolo[3,4-b]quinolin-2(3H)-yl)-3-phenylpropanoate")
