![6-[4-(Trifluoromethyl)phenyl]hex-5-ynenitrile](/api/spectrum/LxCyTLP8pWY/structure.png?h=300&w=458 "6-[4-(Trifluoromethyl)phenyl]hex-5-ynenitrile")
| SpectraBase Compound ID | 1QaqhWpeBCp |
|---|---|
| InChI | InChI=1S/C13H10F3N/c14-13(15,16)12-8-6-11(7-9-12)5-3-1-2-4-10-17/h6-9H,1-2,4H2 |
| InChIKey | QXOPEKRLSPYMLF-UHFFFAOYSA-N |
| Mol Weight | 237.23 g/mol |
| Molecular Formula | C13H10F3N |
| Exact Mass | 237.076534 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LxCyTLP8pWY |
|---|---|
| Name | 6-[4-(Trifluoromethyl)phenyl]hex-5-ynenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H10F3N |
| InChI | InChI=1S/C13H10F3N/c14-13(15,16)12-8-6-11(7-9-12)5-3-1-2-4-10-17/h6-9H,1-2,4H2 |
| InChIKey | QXOPEKRLSPYMLF-UHFFFAOYSA-N |
| Molecular Weight | 237.225 g/mol |
| SMILES | C(c1ccc(C#CCCCC#N)cc1)(F)(F)F |
| SPLASH | splash10-001d-2950000000-f4036a54f8b3e4bb9849 |
| Source of Spectrum | F4-42-2089-3c |
| Wiley ID | 1674159 |