SpectraBase Spectrum ID |
JPNBAdX7Sw6 |
Name |
5,16-[1',2']benzeno-5,16-dihydrohexacene |
CAS Registry Number |
108947-54-2 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C32H20 |
InChI |
InChI=1S/C32H20/c1-2-8-20-14-22-16-24-18-30-29(17-23(24)15-21(22)13-19(20)7-1)31-25-9-3-5-11-27(25)32(30)28-12-6-4-10-26(28)31/h1-18,31-32H/t31-,32+ |
InChIKey |
XIKBDCPTNLEILR-MEKGRNQZSA-N |
Molecular Weight |
404.512 g/mol |
SMILES |
[C@]12(c3c(cc4c(c3)cc3c(cc5c(c3)cccc5)c4)[C@@](c3c1cccc3)(c1c2cccc1)[H])[H] |
SPLASH |
splash10-0udi-0020900000-8436f0053118811b797c |
Source of Spectrum |
J-52-3636-30 |
Synonyms |
octacyclo[18.6.6.0(2,19).0(4,17).0(6,15).0(8,13).0(21,26).0(27,32)]dotriaconta-2(19),3,5,7,9,11,13,15,17,21,23,25,27,29,31-pentadecaene |
Wiley ID |
1371631 |