| SpectraBase Spectrum ID |
H0SgZEIWSXZ |
| Name |
2,3,6,7,9,10-Hexaheptylanthracene |
| CAS Registry Number |
113568-73-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C56H94 |
| InChI |
InChI=1S/C56H94/c1-7-13-19-25-31-37-47-43-53-51(41-35-29-23-17-11-5)55-45-49(39-33-27-21-15-9-3)50(40-34-28-22-16-10-4)46-56(55)52(42-36-30-24-18-12-6)54(53)44-48(47)38-32-26-20-14-8-2/h43-46H,7-42H2,1-6H3 |
| InChIKey |
VXOJMFRDBCDDQK-UHFFFAOYSA-N |
| Molecular Weight |
767.368 g/mol |
| SMILES |
c12c(c(CCCCCCC)c3c(c2CCCCCCC)cc(c(CCCCCCC)c3)CCCCCCC)cc(c(c1)CCCCCCC)CCCCCCC |
| SPLASH |
splash10-014i-0000001900-6559c4e5d25a352cfe10 |
| Source of Spectrum |
K-121-1196-23 |
| Wiley ID |
1416658 |
