| SpectraBase Spectrum ID |
HkbGJhmxEEQ |
| Name |
4-Bromomethyl[2.2.2]paracyclophane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H25Br |
| InChI |
InChI=1S/C25H25Br/c26-18-25-17-23-12-11-21-5-3-19(4-6-21)1-2-20-7-9-22(10-8-20)13-15-24(25)16-14-23/h3-10,14,16-17H,1-2,11-13,15,18H2 |
| InChIKey |
OPHFAUBEZDLGEW-UHFFFAOYSA-N |
| Molecular Weight |
405.379 g/mol |
| SMILES |
c1(c2CCc3ccc(cc3)CCc3ccc(CCc(c1)cc2)cc3)CBr |
| SPLASH |
splash10-004i-0009300000-9787620397851bf558ca |
| Source of Spectrum |
U-1995-1525-7 |
| Synonyms |
5-(bromomethyl)tetracyclo[14.2.2.2(4,7).2(10,13)]tetracosa-1(18),4,6,10,12,16,19,21,23-nonaene |
| Wiley ID |
767310 |
![4-Bromomethyl[2.2.2]paracyclophane](/api/spectrum/HkbGJhmxEEQ/structure.png?h=300&w=458 "4-Bromomethyl[2.2.2]paracyclophane")
