| SpectraBase Spectrum ID |
7XbyUpW3CCg |
| Name |
1,1,4,4-Tetrakis(4-chlorophenyl)but-2-yne-1,4-diol |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H18Cl4O2 |
| InChI |
InChI=1S/C28H18Cl4O2/c29-23-9-1-19(2-10-23)27(33,20-3-11-24(30)12-4-20)17-18-28(34,21-5-13-25(31)14-6-21)22-7-15-26(32)16-8-22/h1-16,33-34H |
| InChIKey |
DPQDIRKZZJJHLH-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN SSQ7000 |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/anie.201905670 |
| Molecular Weight |
528.262 g/mol |
| Reported Formula |
C28H18Cl4O2 |
| SMILES |
OC(C#CC(c1ccc(cc1)Cl)(c1ccc(cc1)Cl)O)(c1ccc(cc1)Cl)c1ccc(cc1)Cl |
| SPLASH |
splash10-000i-0901000000-1d28fac425fc4afc620b |
| Source of Spectrum |
ACI-58-SM11-2e |
| Wiley ID |
1875491 |
