| SpectraBase Compound ID | 1Jv1ZJ4JIkM |
|---|---|
| InChI | InChI=1S/C8H12O3/c1-4-5-10-8(9)11-6-7(2)3/h1,7H,5-6H2,2-3H3 |
| InChIKey | IOYCFYZGKFDMKF-UHFFFAOYSA-N |
| Mol Weight | 156.18 g/mol |
| Molecular Formula | C8H12O3 |
| Exact Mass | 156.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7YBVfACvI9G |
|---|---|
| Name | Isobutyl prop-2-ynyl carbonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.078644243 u |
| Formula | C8H12O3 |
| InChI | InChI=1S/C8H12O3/c1-4-5-10-8(9)11-6-7(2)3/h1,7H,5-6H2,2-3H3 |
| InChIKey | IOYCFYZGKFDMKF-UHFFFAOYSA-N |
| Molecular Weight | 156.181 g/mol |
| SMILES | C(COC(OCC(C)C)=O)#C |