| SpectraBase Spectrum ID |
1tLRqdnuwVk |
| Name |
(3ar*,9as*)-N-(Methoxycarbonyl)-6-oxo-2,3,3A,9A-tetrahydropyrrolo[2',3' :4,5][1,3]oxazolo[3,2-A]pyrimidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
237.074955842 u |
| Formula |
C10H11N3O4 |
| InChI |
InChI=1S/C10H11N3O4/c1-16-10(15)13-4-2-6-8(13)12-5-3-7(14)11-9(12)17-6/h3,5-6,8H,2,4H2,1H3 |
| InChIKey |
HSJLBBXCDBQWRO-UHFFFAOYSA-N |
| Molecular Weight |
237.215 g/mol |
| SMILES |
C1=2N(C=CC(N2)=O)C2C(O1)CCN2C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914064 |
![(3aR*,9aS*)-N-(Methoxycarbonyl)-6-oxo-2,3,3a,9a-tetrahydropyrrolo[2',3' :4,5][1,3]oxazolo[3,2-a]pyrimidine](/api/spectrum/1tLRqdnuwVk/structure.png?h=300&w=458 "(3aR*,9aS*)-N-(Methoxycarbonyl)-6-oxo-2,3,3a,9a-tetrahydropyrrolo[2',3' :4,5][1,3]oxazolo[3,2-a]pyrimidine")
