| SpectraBase Compound ID | 1G3VIMWhwp |
|---|---|
| InChI | InChI=1S/C7H14O/c1-5-6-8-7(2,3)4/h5-6H,1-4H3/b6-5+ |
| InChIKey | XGCRQUBGQPXCPL-AATRIKPKSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CZA9oo0NGJE |
|---|---|
| Name | (E)-1-Tert-butoxyprop-1-ene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 114.104465070 u |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-5-6-8-7(2,3)4/h5-6H,1-4H3/b6-5+ |
| InChIKey | XGCRQUBGQPXCPL-AATRIKPKSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | C(O\C=C\C)(C)(C)C |