| SpectraBase Compound ID | HNIRiWRIKI0 |
|---|---|
| InChI | InChI=1S/C8H7N3O3/c1-13-8(12)6-7(10-14-9-6)11-4-2-3-5-11/h2-5H,1H3 |
| InChIKey | VVCBKRUJXJUYNC-UHFFFAOYSA-N |
| Mol Weight | 193.16 g/mol |
| Molecular Formula | C8H7N3O3 |
| Exact Mass | 193.048741 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J6NnC4rCMwH |
|---|---|
| Name | Methyl 4-(pyrrol-1-yl)-1,2,5-oxadiazole-3-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.048741094 u |
| Formula | C8H7N3O3 |
| InChI | InChI=1S/C8H7N3O3/c1-13-8(12)6-7(10-14-9-6)11-4-2-3-5-11/h2-5H,1H3 |
| InChIKey | VVCBKRUJXJUYNC-UHFFFAOYSA-N |
| Molecular Weight | 193.162 g/mol |
| SMILES | C=1C=CN(C1)C=1C(=NON1)C(OC)=O |