![[(E)-hept-5-en-1,3-diynyl]benzene](/api/spectrum/ALnA4ZxNNMC/structure.png?h=300&w=458 "[(E)-hept-5-en-1,3-diynyl]benzene")
| SpectraBase Compound ID | LtLmpYNvfAl |
|---|---|
| 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-NSCUHMNNSA-N |
| Mol Weight | 166.22 g/mol |
| Molecular Formula | C13H10 |
| Exact Mass | 166.07825 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ALnA4ZxNNMC |
|---|---|
| Name | [(E)-hept-5-en-1,3-diynyl]benzene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| 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-NSCUHMNNSA-N |
| Molecular Weight | 166.223 g/mol |
| SMILES | C(C#Cc1ccccc1)#C\C=C\C |
| SPLASH | splash10-014i-0900000000-e96507104ab042ed844f |
| Source of Spectrum | QB-13-657-1 |
| Wiley ID | 841099 |