![1,5,6,7A-Tetrahydropyrrolo[1,2-C]oxazole-3,7-dione](/api/spectrum/LnNKGo6SDpM/structure.png?h=300&w=458 "1,5,6,7A-Tetrahydropyrrolo[1,2-C]oxazole-3,7-dione")
| SpectraBase Compound ID | AstEWpMUxP6 |
|---|---|
| InChI | InChI=1S/C6H7NO3/c8-5-1-2-7-4(5)3-10-6(7)9/h4H,1-3H2 |
| InChIKey | XPMJERFUPISLMH-UHFFFAOYSA-N |
| Mol Weight | 141.13 g/mol |
| Molecular Formula | C6H7NO3 |
| Exact Mass | 141.042593 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LnNKGo6SDpM |
|---|---|
| Name | 1,5,6,7A-Tetrahydropyrrolo[1,2-C]oxazole-3,7-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 141.042593086 u |
| Formula | C6H7NO3 |
| InChI | InChI=1S/C6H7NO3/c8-5-1-2-7-4(5)3-10-6(7)9/h4H,1-3H2 |
| InChIKey | XPMJERFUPISLMH-UHFFFAOYSA-N |
| Molecular Weight | 141.126 g/mol |
| SMILES | C1(N2C(CO1)C(CC2)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.911403 |