| SpectraBase Spectrum ID |
LotqLGHSvDi |
| Name |
Dimethyl 2-oxo-1-ethyl-1,11B-dihydro-2H-pyrimido[2,1-A]isoquinoline-3,4-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.121571683 u |
| Formula |
C18H18N2O5 |
| InChI |
InChI=1S/C18H18N2O5/c1-4-19-15-12-8-6-5-7-11(12)9-10-20(15)14(18(23)25-3)13(16(19)21)17(22)24-2/h5-10,15H,4H2,1-3H3 |
| InChIKey |
YMMCETDTUSFMHX-UHFFFAOYSA-N |
| Molecular Weight |
342.351 g/mol |
| SMILES |
C=1(C(N(CC)C2N(C1C(=O)OC)C=CC=1C=CC=CC21)=O)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918087 |
![Dimethyl 2-oxo-1-ethyl-1,11b-dihydro-2H-pyrimido[2,1-a]isoquinoline-3,4-dicarboxylate](/api/spectrum/LotqLGHSvDi/structure.png?h=300&w=458 "Dimethyl 2-oxo-1-ethyl-1,11b-dihydro-2H-pyrimido[2,1-a]isoquinoline-3,4-dicarboxylate")
