![[(3Z)-hepta-3,6-dien-1-ynyl]benzene](/api/spectrum/BlRG1tmFga9/structure.png?h=300&w=458 "[(3Z)-hepta-3,6-dien-1-ynyl]benzene")
| SpectraBase Compound ID | BIrhttow2Yk |
|---|---|
| InChI | InChI=1S/C13H12/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h2,4-6,8-9,11-12H,1,3H2/b5-4- |
| InChIKey | ZKLLRBWOELGKQH-PLNGDYQASA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C13H12 |
| Exact Mass | 168.0939 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BlRG1tmFga9 |
|---|---|
| Name | [(3Z)-hepta-3,6-dien-1-ynyl]benzene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H12 |
| InChI | InChI=1S/C13H12/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h2,4-6,8-9,11-12H,1,3H2/b5-4- |
| InChIKey | ZKLLRBWOELGKQH-PLNGDYQASA-N |
| Molecular Weight | 168.239 g/mol |
| SMILES | C(#Cc1ccccc1)\C=C/CC=C |
| SPLASH | splash10-014i-0900000000-d0d2c32a41e054f904a3 |
| Source of Spectrum | F-56-3497-4 |
| Wiley ID | 857007 |