![[(Z)-hept-5-en-1,3-diynyl]benzene](/api/spectrum/30PfU61th3U/structure.png?h=300&w=458 "[(Z)-hept-5-en-1,3-diynyl]benzene")
| SpectraBase Compound ID | FAVAAB9MYq2 |
|---|---|
| InChI | InChI=1S/C13H10/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h2-3,6,8-9,11-12H,1H3/b3-2- |
| InChIKey | OQOPFMDMSRLRRH-IHWYPQMZSA-N |
| Mol Weight | 166.22 g/mol |
| Molecular Formula | C13H10 |
| Exact Mass | 166.07825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 30PfU61th3U |
|---|---|
| Name | [(Z)-Hept-5-en-1,3-diynyl]benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.078250322 u |
| Formula | C13H10 |
| InChI | InChI=1S/C13H10/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h2-3,6,8-9,11-12H,1H3/b3-2- |
| InChIKey | OQOPFMDMSRLRRH-IHWYPQMZSA-N |
| Molecular Weight | 166.223 g/mol |
| SMILES | C(C#CC1=CC=CC=C1)#C\C=C/C |