![[(Z)-6-phenylhex-3-en-1,5-diynyl]benzene](/api/spectrum/2JvdmCXHntM/structure.png?h=300&w=458 "[(Z)-6-phenylhex-3-en-1,5-diynyl]benzene")
| SpectraBase Compound ID | ICUsRyVihNV |
|---|---|
| InChI | InChI=1S/C18H12/c1(5-11-17-13-7-3-8-14-17)2-6-12-18-15-9-4-10-16-18/h1-4,7-10,13-16H/b2-1- |
| InChIKey | ZZOLVPYFGLQRQS-UPHRSURJSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C18H12 |
| Exact Mass | 228.0939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2JvdmCXHntM |
|---|---|
| Name | [(Z)-6-Phenylhex-3-en-1,5-diynyl]benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.093900386 u |
| Formula | C18H12 |
| InChI | InChI=1S/C18H12/c1(5-11-17-13-7-3-8-14-17)2-6-12-18-15-9-4-10-16-18/h1-4,7-10,13-16H/b2-1- |
| InChIKey | ZZOLVPYFGLQRQS-UPHRSURJSA-N |
| Molecular Weight | 228.294 g/mol |
| SMILES | C(#CC1=CC=CC=C1)\C=C/C#CC1=CC=CC=C1 |