| SpectraBase Compound ID | G1YP8vHeSEW |
|---|---|
| InChI | InChI=1S/C14H16O2/c1-4-12(2)9-10-16-11-13-5-7-14(15-3)8-6-13/h1,5-9H,10-11H2,2-3H3/b12-9+ |
| InChIKey | GXYCRUQKZASZDT-FMIVXFBMSA-N |
| Mol Weight | 216.28 g/mol |
| Molecular Formula | C14H16O2 |
| Exact Mass | 216.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 97B3hn4LUrA |
|---|---|
| Name | (E)-1-(4-Methoxybenzyloxy)-3-methylpent-2-en-4-yne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.115029753 u |
| Formula | C14H16O2 |
| InChI | InChI=1S/C14H16O2/c1-4-12(2)9-10-16-11-13-5-7-14(15-3)8-6-13/h1,5-9H,10-11H2,2-3H3/b12-9+ |
| InChIKey | GXYCRUQKZASZDT-FMIVXFBMSA-N |
| Molecular Weight | 216.280 g/mol |
| SMILES | C(#C)\C(=C\COCC=1C=CC(=CC1)OC)C |