| SpectraBase Spectrum ID |
KRFMgqBTABD |
| Name |
5-Keto-2,3-dihydrothiazolo[3,2-A]pyrimidine-6-carboxylic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
212.025563297 u |
| Formula |
C8H8N2O3S |
| InChI |
InChI=1S/C8H8N2O3S/c1-13-7(12)5-4-9-8-10(6(5)11)2-3-14-8/h4H,2-3H2,1H3 |
| InChIKey |
VTKGKNGZHZWDQU-UHFFFAOYSA-N |
| Molecular Weight |
212.223 g/mol |
| SMILES |
C1(=O)C(=CN=C2N1CCS2)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844033 |
![5-Keto-2,3-dihydrothiazolo[3,2-A]pyrimidine-6-carboxylic acid methyl ester](/api/spectrum/KRFMgqBTABD/structure.png?h=300&w=458 "5-Keto-2,3-dihydrothiazolo[3,2-A]pyrimidine-6-carboxylic acid methyl ester")
