| SpectraBase Spectrum ID |
1FWTfTbdHdq |
| Name |
4b,8b,12b,12d-Tetramethyl-2,3,6,7,10,11-hexakis(phenylethynyl)-4b,8b,12b,12d-tetrahydrodibenzo[2,3:4,5]pentaleno[1,6-ab]indene |
| Alternate Name(s) |
1,8,15,22-tetramethyl-4,5,11,12,18,19-hexakis(2-phenylethynyl)hexacyclo[13.6.1.0(2,7).0(8,22).0(9,14).0(16,21)]docosa-2(7),3,5,9(14),10,12,16(21),17,19-nonaene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C74H48 |
| InChI |
InChI=1S/C74H48/c1-71-65-47-59(41-35-53-23-11-5-12-24-53)61(43-37-55-27-15-7-16-28-55)49-67(65)72(2)69-51-63(45-39-57-31-19-9-20-32-57)64(46-40-58-33-21-10-22-34-58)52-70(69)73(3,74(71,72)4)68-50-62(44-38-56-29-17-8-18-30-56)60(48-66(68)71)42-36-54-25-13-6-14-26-54/h5-34,47-52H,1-4H3/t71-,72+,73-,74+ |
| InChIKey |
XSZZUZJAHJZZGM-HKTZSUIUSA-N |
| Molecular Weight |
937.198 g/mol |
| SMILES |
C12([C@]3(c4cc(C#Cc5ccccc5)c(C#Cc5ccccc5)cc4[C@@]1(c1cc(C#Cc4ccccc4)c(C#Cc4ccccc4)cc1[C@@]2(c1cc(C#Cc2ccccc2)c(C#Cc2ccccc2)cc31)C)C)C)C |
| SPLASH |
splash10-00di-0100100009-90911dc6b9bb85471d21 |
| Source of Spectrum |
KC-57-3611-70 |
| Wiley ID |
1623889 |
![4b,8b,12b,12d-Tetramethyl-2,3,6,7,10,11-hexakis(phenylethynyl)-4b,8b,12b,12d-tetrahydrodibenzo[2,3:4,5]pentaleno[1,6-ab]indene](/api/spectrum/1FWTfTbdHdq/structure.png?h=300&w=458 "4b,8b,12b,12d-Tetramethyl-2,3,6,7,10,11-hexakis(phenylethynyl)-4b,8b,12b,12d-tetrahydrodibenzo[2,3:4,5]pentaleno[1,6-ab]indene")
