| SpectraBase Spectrum ID |
D4JBmMLs1Er |
| Name |
2,4(1H,3H)-Pyrimidinedione, 1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
293.112403979 u |
| Formula |
C12H15N5O4 |
| InChI |
InChI=1S/C12H15N5O4/c1-21-8-7-17(12(20)15-10(8)18)5-2-4-16-6-3-9(13)14-11(16)19/h3,6-7H,2,4-5H2,1H3,(H2,13,14,19)(H,15,18,20) |
| InChIKey |
QMRLEFSTRDFWDP-UHFFFAOYSA-N |
| Molecular Weight |
293.283 g/mol |
| SMILES |
C1(NC(C(=CN1CCCN1C(N=C(C=C1)N)=O)OC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974605 |
![2,4(1H,3H)-Pyrimidinedione, 1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methoxy-](/api/spectrum/D4JBmMLs1Er/structure.png?h=300&w=458 "2,4(1H,3H)-Pyrimidinedione, 1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methoxy-")
