| SpectraBase Compound ID | 9BuWseJjewK |
|---|---|
| InChI | InChI=1S/C18H18O2/c1-15-5-9-17(10-6-15)19-13-3-4-14-20-18-11-7-16(2)8-12-18/h5-12H,13-14H2,1-2H3 |
| InChIKey | LDQLTMMUMUGYKT-UHFFFAOYSA-N |
| Mol Weight | 266.34 g/mol |
| Molecular Formula | C18H18O2 |
| Exact Mass | 266.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6iJIjt7EEFV |
|---|---|
| Name | 1,4-bis(p-Tolyloxy)-2-butyne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.130679818 u |
| Formula | C18H18O2 |
| InChI | InChI=1S/C18H18O2/c1-15-5-9-17(10-6-15)19-13-3-4-14-20-18-11-7-16(2)8-12-18/h5-12H,13-14H2,1-2H3 |
| InChIKey | LDQLTMMUMUGYKT-UHFFFAOYSA-N |
| Molecular Weight | 266.340 g/mol |
| SMILES | C=1C(=CC=C(C1)C)OCC#CCOC=1C=CC(=CC1)C |