| SpectraBase Compound ID | 3smwEWChexc |
|---|---|
| InChI | InChI=1S/C13H14/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6-12H,2-3H2,1H3/b10-7+ |
| InChIKey | XYBLFWCYOSLJGO-JXMROGBWSA-N |
| Mol Weight | 170.25 g/mol |
| Molecular Formula | C13H14 |
| Exact Mass | 170.10955 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 39tR5DfCVc |
|---|---|
| Name | [(E)-hept-1-en-3-ynyl]benzene |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14 |
| InChI | InChI=1S/C13H14/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6-12H,2-3H2,1H3/b10-7+ |
| InChIKey | XYBLFWCYOSLJGO-JXMROGBWSA-N |
| Molecular Weight | 170.255 g/mol |
| SMILES | C(\C=C\c1ccccc1)#CCCC |
| SPLASH | splash10-00kf-1900000000-d585cd373eb9ab922cf2 |
| Source of Spectrum | KC-0-2478-12 |
| Wiley ID | 782002 |