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1,4-bis(3-Iodobicyclo[1.1.1][pent-1-yl)cubane
SpectraBase Compound ID L4HJKfVDW7d
InChI InChI=1S/C18H18I2/c19-15-1-13(2-15,3-15)17-7-10-8(17)12-9(17)11(7)18(10,12)14-4-16(20,5-14)6-14/h7-12H,1-6H2/t7-,8+,9-,10-,11+,12-,13?,14?,15-,16-,17-,18-
InChIKey CVLBESAOOQJJGM-UHFFFAOYSA-N
Mol Weight 488.15 g/mol
Molecular Formula C18H18I2
Exact Mass 487.949791 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8uER2jPnmGG
Name 1,4-bis(3-iodobicyclo[1.1.1][pent-1-yl)cubane
CAS Registry Number 124381-08-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18I2
InChI InChI=1S/C18H18I2/c19-15-1-13(2-15,3-15)17-7-10-8(17)12-9(17)11(7)18(10,12)14-4-16(20,5-14)6-14/h7-12H,1-6H2/t7-,8+,9-,10-,11+,12-,13?,14?,15-,16-,17-,18-
InChIKey CVLBESAOOQJJGM-UHFFFAOYSA-N
Molecular Weight 488.151 g/mol
SMILES C12([C@]3([C@]4([C@@]1([C@@]1(C4(C45CC(C4)(I)C5)[C@]3([C@]21[H])[H])[H])[H])[H])[H])C12CC(C2)(I)C1
SPLASH splash10-0gdi-8910000000-cdcf0a04d643a0a43fc0
Source of Spectrum J-55-1015-8
Synonyms 1,4-bis(3-iodobicyclo[1.1.1][ent-1-yl)cubane
Wiley ID 1396779