| SpectraBase Compound ID | 1UqBCeiB805 |
|---|---|
| InChI | InChI=1S/C16H10Cl4O2/c17-11-3-5-15(13(19)9-11)21-7-1-2-8-22-16-6-4-12(18)10-14(16)20/h3-6,9-10H,7-8H2 |
| InChIKey | KWGPWHCQDJFCNA-UHFFFAOYSA-N |
| Mol Weight | 376.1 g/mol |
| Molecular Formula | C16H10Cl4O2 |
| Exact Mass | 373.94349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6u83SOE5N2E |
|---|---|
| Name | 1,4-bis(2,4-Dichlorophenoxy)-2-butyne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 373.943490360 u |
| Formula | C16H10Cl4O2 |
| InChI | InChI=1S/C16H10Cl4O2/c17-11-3-5-15(13(19)9-11)21-7-1-2-8-22-16-6-4-12(18)10-14(16)20/h3-6,9-10H,7-8H2 |
| InChIKey | KWGPWHCQDJFCNA-UHFFFAOYSA-N |
| Molecular Weight | 376.066 g/mol |
| SMILES | C=1C(=C(C=C(C1)Cl)Cl)OCC#CCOC=1C(=CC(=CC1)Cl)Cl |