| SpectraBase Spectrum ID |
3vOHCUOxTk |
| Name |
2-(4-Phenylbuta-1,3-diynyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene |
| Alternate Name(s) |
2-(4-phenyl-1,3-butadiynyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H14 |
| InChI |
InChI=1S/C21H14/c1-2-9-18(10-3-1)11-4-6-14-20-16-8-13-19-12-5-7-15-21(20)17-19/h1-3,5,7-10,12-13,15-16H,17H2 |
| InChIKey |
LRPRTJLWGJNFID-UHFFFAOYSA-N |
| Molecular Weight |
266.343 g/mol |
| SMILES |
C12=C(C=CC=C(C=CC=C2)C1)C#CC#Cc1ccccc1 |
| SPLASH |
splash10-014i-0090000000-0677e30f00498c6915f2 |
| Source of Spectrum |
SO-0-1509-10 |
| Wiley ID |
1546097 |
![2-(4-Phenylbuta-1,3-diynyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene](/api/spectrum/3vOHCUOxTk/structure.png?h=300&w=458 "2-(4-Phenylbuta-1,3-diynyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene")
