| SpectraBase Compound ID | 5gA7m9NsE3n |
|---|---|
| InChI | InChI=1S/C16H16F2/c1-3-5-7-9-13-11-15(17)16(18)12-14(13)10-8-6-4-2/h11-12H,3-6H2,1-2H3 |
| InChIKey | UUOWWXPGAPMZCV-UHFFFAOYSA-N |
| Mol Weight | 246.3 g/mol |
| Molecular Formula | C16H16F2 |
| Exact Mass | 246.122007 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KUkAxjmre8V |
|---|---|
| Name | 1,2-Difluoro-4,5-bis-(pent-1-ynyl)-benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.122006841 u |
| Formula | C16H16F2 |
| InChI | InChI=1S/C16H16F2/c1-3-5-7-9-13-11-15(17)16(18)12-14(13)10-8-6-4-2/h11-12H,3-6H2,1-2H3 |
| InChIKey | UUOWWXPGAPMZCV-UHFFFAOYSA-N |
| Molecular Weight | 246.301 g/mol |
| SMILES | C1(F)=C(F)C=C(C(=C1)C#CCCC)C#CCCC |