| SpectraBase Spectrum ID |
49Qn0KMyeCA |
| Name |
[2.2.2.1] Paracyclophane-1,17-diyne |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H22 |
| InChI |
InChI=1S/C31H22/c1-2-25-5-9-27(10-6-25)12-14-29-17-21-31(22-18-29)23-30-19-15-28(16-20-30)13-11-26-7-3-24(1)4-8-26/h3-10,15-22H,1-2,23H2 |
| InChIKey |
ODVKEGGTYANOCK-UHFFFAOYSA-N |
| Molecular Weight |
394.517 g/mol |
| SMILES |
C1#Cc2ccc(cc2)CCc2ccc(cc2)C#Cc2ccc(Cc3ccc1cc3)cc2 |
| SPLASH |
splash10-0007-0209000000-b241fad4a03fb52a9244 |
| Source of Spectrum |
K-125-2537-3 |
| Synonyms |
Pentacyclo[19.2.2.2(3,6).2(9,12).2(15,18)]hentriaconta-1(23),3,5,9,11,15,17,21,24,26,28,30-dodecaene-7,19-diyne |
| Wiley ID |
1366930 |
![[2.2.2.1] Paracyclophane-1,17-diyne](/api/spectrum/49Qn0KMyeCA/structure.png?h=300&w=458 "[2.2.2.1] Paracyclophane-1,17-diyne")
