SpectraBase Spectrum ID |
4zmP7of7mC |
Name |
exo-8,exo-14-Dibromo-5,6;12,13-bisbenzopentacyclo[8.3.1.0(2,7).0(3,11).0(4,9)]tetradec-5,12-diene |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H18Br2 |
InChI |
InChI=1S/C22H18Br2/c23-21-15-11-7-3-1-5-9(11)13-17-14-10-6-2-4-8-12(10)16(18(15)17)22(24)20(14)19(13)21/h1-8,13-22H/t13-,14+,15+,16-,17+,18-,19-,20+,21-,22-/m1/s1 |
InChIKey |
CCOYVNFYPKATOA-UHFFFAOYSA-N |
Molecular Weight |
442.194 g/mol |
SMILES |
[C@]12([C@@]3([C@]4(c5c([C@@]2([C@]([C@@]4(Br)[H])([C@]2([C@@]1(c1c(cccc1)[C@@]3([C@]2(Br)[H])[H])[H])[H])[H])[H])cccc5)[H])[H])[H] |
SPLASH |
splash10-0ugi-0941200000-9d286fe1c8ebc0e07308 |
Source of Spectrum |
F-51-2925-36 |
Synonyms |
12,22-dibromoheptacyclo[12.7.1.0(2,11).0(3,15).0(4,13).0(5,10).0(16,21)]docosa-5,7,9,16,18,20-hexaene |
Wiley ID |
791371 |