| SpectraBase Compound ID | 2C1Ow8NSImG |
|---|---|
| InChI | InChI=1S/C16H8F3N/c17-16(18,19)15-3-1-2-13(10-15)7-4-12-5-8-14(11-20)9-6-12/h1-3,5-6,8-10H |
| InChIKey | NGXRXLOWGVSBSJ-UHFFFAOYSA-N |
| Mol Weight | 271.24 g/mol |
| Molecular Formula | C16H8F3N |
| Exact Mass | 271.060884 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | wAT0AXo63P |
|---|---|
| Name | (4-Cyanophenyl)(3-trifluoromethylphenyl)ethyne |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H8F3N |
| InChI | InChI=1S/C16H8F3N/c17-16(18,19)15-3-1-2-13(10-15)7-4-12-5-8-14(11-20)9-6-12/h1-3,5-6,8-10H |
| InChIKey | NGXRXLOWGVSBSJ-UHFFFAOYSA-N |
| Molecular Weight | 271.242 g/mol |
| SMILES | C(c1cc(C#Cc2ccc(C#N)cc2)ccc1)(F)(F)F |
| SPLASH | splash10-00di-0190000000-318f5090c07524196931 |
| Source of Spectrum | F-68-4879-3z |
| Wiley ID | 1709057 |