SpectraBase Spectrum ID |
BzMnQSVrBua |
Name |
5-Amino-6-[(3-hydroxypropyl)amino]-3-methylpyrimidine-2,4(1H,3H)-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
214.106590324 u |
Formula |
C8H14N4O3 |
InChI |
InChI=1S/C8H14N4O3/c1-12-7(14)5(9)6(11-8(12)15)10-3-2-4-13/h10,13H,2-4,9H2,1H3,(H,11,15) |
InChIKey |
BIBIBBVXYIAQOD-UHFFFAOYSA-N |
SMILES |
C1(N(C(C(=C(N1)NCCCO)N)=O)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842587 |