| SpectraBase Spectrum ID |
LczKmJooTL6 |
| Name |
5-(Hydroxymethyl)uracil, hemihydrate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
151.043124400 u |
| Formula |
C5H6N2O3·½H2O |
| InChI |
InChI=1S/2C5H6N2O3.H2O/c2*8-2-3-1-6-5(10)7-4(3)9;/h2*1,8H,2H2,(H2,6,7,9,10);1H2 |
| InChIKey |
PKRNJWWIXADPAH-UHFFFAOYSA-N |
| Molecular Weight |
151.121 g/mol |
| Nominal Mass |
151 u |
| SMILES |
O.N1C(C(CO)=CNC1=O)=O |
| Spectrum/Structure Validation Score (Raman) |
0.948001 |
