For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Pentacyclo[20.2.2.2(4,7).2(10,13).2(16,19)]dotriaconta-2,4,6,8,10,12,14,16,18,20,22,24,25,27,29,31-hexadecaene, 5,17(or 6,17)-diiodo-
SpectraBase Compound ID CEsbpgPhAK1
InChI InChI=1S/C32H22I2/c33-31-18-14-28-10-8-24-4-2-6-26(20-24)12-16-30-21-27(13-17-32(30)34)9-7-23-3-1-5-25(19-23)11-15-29(31)22-28/h1-22H/b9-7-,10-8-,15-11-,16-12-
InChIKey VANXQLJDGAKZJF-CCOPZYDVSA-N
Mol Weight 660.3 g/mol
Molecular Formula C32H22I2
Exact Mass 659.981091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7yaSoAeTJZF
Name Pentacyclo[20.2.2.2(4,7).2(10,13).2(16,19)]dotriaconta-2,4,6,8,10,12,14,16,18,20,22,24,25,27,29,31-hexadecaene, 5,17(or 6,17)-diiodo-
CAS Registry Number 59934-31-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H22I2
InChI InChI=1S/C32H22I2/c33-31-18-14-28-10-8-24-4-2-6-26(20-24)12-16-30-21-27(13-17-32(30)34)9-7-23-3-1-5-25(19-23)11-15-29(31)22-28/h1-22H/b9-7-,10-8-,15-11-,16-12-
InChIKey VANXQLJDGAKZJF-CCOPZYDVSA-N
Molecular Weight 660.337 g/mol
SMILES c12\C=C/c3cc(\C=C/c4cc(\C=C/c5cc(\C=C/c(ccc2I)c1)ccc5)c(cc4)I)ccc3
SPLASH splash10-03di-0000409000-0e19c9887f372c7de718
Source of Spectrum SB-30-370-0
Synonyms 4,20(21)-di-iodo[2.2.2.2]paracyclophanetetraene 5,19-diiodopentacyclo[23.3.1.1(4,8).1(11,15).1(18,22)]dotriaconta-1(29),2,4(32),5,7,9,11(31),12,14,16,18(30),19,21,23,25,27-hexadecaene
Wiley ID 1413558