SpectraBase Spectrum ID |
LPDWyscNrRl |
Name |
2,5,8,11-Tetraisopropyl-cycloocta[1,2,3,4-def : 5,6,7,8-d',e',f']bisphenylene |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C36H36 |
InChI |
InChI=1S/C36H36/c1-17(2)21-9-25-26-10-22(18(3)4)15-31-32-16-24(20(7)8)12-28-27-11-23(19(5)6)14-30(35(27)36(28)32)29(13-21)33(25)34(26)31/h9-20H,1-8H3/b30-29-,32-31- |
InChIKey |
BFWKZLKNISNYFM-IOYDOZLVSA-N |
Molecular Weight |
468.684 g/mol |
SMILES |
c12-c3c4-c5cc(C(C)C)cc-6c5-c5c(-c2cc(C(C)C)cc1-c3cc(C(C)C)c4)cc(C(C)C)cc65 |
SPLASH |
splash10-014i-0000900000-797903805e0a9bd8e3c8 |
Source of Spectrum |
C-124-4691-3 |
Wiley ID |
1701023 |