| SpectraBase Compound ID | 6MOY4T5xLRO |
|---|---|
| InChI | InChI=1S/C7H10N2O/c1-5(2)7-3-6(4-8)10-9-7/h5-6H,3H2,1-2H3 |
| InChIKey | SZWGXNNTQMQCJX-UHFFFAOYSA-N |
| Mol Weight | 138.17 g/mol |
| Molecular Formula | C7H10N2O |
| Exact Mass | 138.079313 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AktHgGB0FhK |
|---|---|
| Name | 3-Isopropyl-5-cyano-4,5-dihydroisoxazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 138.079312949 u |
| Formula | C7H10N2O |
| InChI | InChI=1S/C7H10N2O/c1-5(2)7-3-6(4-8)10-9-7/h5-6H,3H2,1-2H3 |
| InChIKey | SZWGXNNTQMQCJX-UHFFFAOYSA-N |
| SMILES | C1(=NOC(C1)C#N)C(C)C |