| SpectraBase Spectrum ID |
XzVKzgvxhb |
| Name |
Bicyclo[28.4.1]pentatriaconta-2,4,6,8,10,12,18,20,22,24,26,28,30,32, 34-pentadecaene-14,16-diyne, 13,18-bis(1,1-dimethylethyl)-, (Z,Z,E,E,E,E,E,E,E,E,E,E)- |
| CAS Registry Number |
115495-26-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H46 |
| InChI |
InChI=1S/C43H46/c1-42(2,3)40-33-23-19-15-11-7-9-13-17-21-29-38-31-25-26-32-39(37-38)30-22-18-14-10-8-12-16-20-24-34-41(43(4,5)6)36-28-27-35-40/h7-26,29-34H,37H2,1-6H3/b9-7-,10-8-,11-7-,12-8-,13-9-,14-10-,15-11-,16-12-,17-13-,18-14-,19-15-,20-16-,21-17-,22-18-,23-19-,24-20-,29-21-,30-22-,33-23-,34-24-,38-29-,39-30-,40-33+,41-34+ |
| InChIKey |
AZWIQGBLMGQCNT-RTGLOQFCSA-N |
| Molecular Weight |
562.841 g/mol |
| SMILES |
C#1\C(=C/C=C\C=C/C=C\C=C/C=C\C=2CC(\C=C/C=C\C=C/C=C\C=C/C=C\(C#CC1)C(C)(C)C)=CC=CC2)C(C)(C)C |
| SPLASH |
splash10-0a4i-9000010000-ca3167738a46465d96c5 |
| Source of Spectrum |
KC-1988-393-27 |
| Synonyms |
13,18-ditert-butylbicyclo[28.4.1]pentatriaconta-1(34),2,4,6,8,10,12,18,20,22,24,26,28,30,32-pentadecaene-14,16-diyne
19,20,21,22-Tetrahydro-18,23-di-t-butyl-1,6-methano[32]annulene |
| Wiley ID |
1407005 |
![Bicyclo[28.4.1]pentatriaconta-2,4,6,8,10,12,18,20,22,24,26,28,30,32, 34-pentadecaene-14,16-diyne, 13,18-bis(1,1-dimethylethyl)-, (Z,Z,E,E,E,E,E,E,E,E,E,E)-](/api/spectrum/XzVKzgvxhb/structure.png?h=300&w=458 "Bicyclo[28.4.1]pentatriaconta-2,4,6,8,10,12,18,20,22,24,26,28,30,32, 34-pentadecaene-14,16-diyne, 13,18-bis(1,1-dimethylethyl)-, (Z,Z,E,E,E,E,E,E,E,E,E,E)-")
