SpectraBase Spectrum ID |
OYNYufO9cB |
Name |
(+)-4-Bromo-15-(p-Toluenesulfonyl)[2.2]paracyclophane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H21BrO2S |
InChI |
InChI=1S/C23H21BrO2S/c1-16-2-12-21(13-3-16)27(25,26)23-15-18-5-4-17-6-8-19(22(24)14-17)10-11-20(23)9-7-18/h2-3,6-9,12-15H,4-5,10-11H2,1H3 |
InChIKey |
NCLXIHNYKYOYJS-UHFFFAOYSA-N |
Molecular Weight |
441.383 g/mol |
SMILES |
c1(S(c2ccc(cc2)C)(=O)=O)c2CCc3c(Br)cc(CCc(c1)cc2)cc3 |
SPLASH |
splash10-0007-0900100000-f868b27c19aff410dd31 |
Source of Spectrum |
J-56-5678-20 |
Synonyms |
12-bromotricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl 4-methylphenyl sulfone
5-Bromo-12-[(4-methylphenyl)sulfonyl]tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene |
Wiley ID |
1384622 |