| SpectraBase Compound ID | DZqdOXJty3R |
|---|---|
| InChI | InChI=1S/C16H28/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h12,14H,3-7,9,11,13,15-16H2,1-2H3/b14-12+ |
| InChIKey | GGGLEUVNRXQLAN-WYMLVPIESA-N |
| Mol Weight | 220.4 g/mol |
| Molecular Formula | C16H28 |
| Exact Mass | 220.219101 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AEp4oqZ59k9 |
|---|---|
| Name | 6-Hexadecen-4-yne, (E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.219100902 u |
| Formula | C16H28 |
| InChI | InChI=1S/C16H28/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h12,14H,3-7,9,11,13,15-16H2,1-2H3/b14-12+ |
| InChIKey | GGGLEUVNRXQLAN-WYMLVPIESA-N |
| Molecular Weight | 220.400 g/mol |
| SMILES | C(CCCCCCCC)\C=C\C#CCCC |