| SpectraBase Compound ID | 5TfX9CSQVJb |
|---|---|
| InChI | InChI=1S/C7H10O/c1-3-4-5-6-7-8-2/h3-4H,7H2,1-2H3/b4-3+ |
| InChIKey | IRERKXMABMJNBT-ONEGZZNKSA-N |
| Mol Weight | 110.16 g/mol |
| Molecular Formula | C7H10O |
| Exact Mass | 110.073165 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FHIbWbAWnxZ |
|---|---|
| Name | (E)-6-Methoxyhex-2-en-4-yne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 110.073164941 u |
| Formula | C7H10O |
| InChI | InChI=1S/C7H10O/c1-3-4-5-6-7-8-2/h3-4H,7H2,1-2H3/b4-3+ |
| InChIKey | IRERKXMABMJNBT-ONEGZZNKSA-N |
| Molecular Weight | 110.156 g/mol |
| SMILES | C(#CCOC)\C=C\C |