| SpectraBase Spectrum ID |
CxQNngbdJsz |
| Name |
(E)-8,8'-(Ethene-1,2-diyl)-bis[5-t-butyl-[2.2]metacyclophane] |
| Alternate Name(s) |
3,24-ditert-butylhexacyclo[24.4.2.1(8,12).1(15,19).0(5,30).0(22,27)]tetratriaconta-1(30),2,4,8(34),9,11,15(33),16,18,22,24,26,28-tridecaene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C42H48 |
| InChI |
InChI=1S/C42H48/c1-41(2,3)37-25-33-17-15-31-11-7-9-29(23-31)13-14-30-10-8-12-32(24-30)16-18-34-26-38(42(4,5)6)28-36-20-19-35(27-37)39(33)21-22-40(34)36/h7-12,21-28H,13-20H2,1-6H3/b22-21- |
| InChIKey |
WHUUJIXAGSXNNC-DQRAZIAOSA-N |
| Molecular Weight |
552.846 g/mol |
| SMILES |
c12\C=C/c3c4CCc5cc(CCc6cc(CCc1cc(cc2CCc3cc(c4)C(C)(C)C)C(C)(C)C)ccc6)ccc5 |
| SPLASH |
splash10-0zfr-6000090000-82278c6eefde28315864 |
| Source of Spectrum |
K-129-294-3 |
| Wiley ID |
1406045 |
![(E)-8,8'-(Ethene-1,2-diyl)-bis[5-t-butyl-[2.2]metacyclophane]](/api/spectrum/CxQNngbdJsz/structure.png?h=300&w=458 "(E)-8,8'-(Ethene-1,2-diyl)-bis[5-t-butyl-[2.2]metacyclophane]")
