| SpectraBase Compound ID | A0X1m82wxdk |
|---|---|
| InChI | InChI=1S/C16H20/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h7-9,11-12,14-15H,2-6H2,1H3/b8-7+ |
| InChIKey | LNXCYJDCFWDBGB-BQYQJAHWSA-N |
| Mol Weight | 212.34 g/mol |
| Molecular Formula | C16H20 |
| Exact Mass | 212.156501 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KwAgCHBIkg2 |
|---|---|
| Name | (E)-1-Phenyldec-3-en-1-yne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.156500644 u |
| Formula | C16H20 |
| InChI | InChI=1S/C16H20/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h7-9,11-12,14-15H,2-6H2,1H3/b8-7+ |
| InChIKey | LNXCYJDCFWDBGB-BQYQJAHWSA-N |
| Molecular Weight | 212.336 g/mol |
| SMILES | C(#C\C=C\CCCCCC)C=1C=CC=CC1 |