CID 36855

Feniodium chloride

Structural Information

Molecular Formula

C₁₂H₆Cl₄I

SMILES

C1=CC(=C(C=C1Cl)Cl)[I+]C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C12H6Cl4I/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6H/q+1

InChIKey

YIQHETKPLWWHBD-UHFFFAOYSA-N

Compound name

bis(2,4-dichlorophenyl)iodanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 151
Patents: 416.82684 Da
Monoisotopic Mass: 6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	417.83412	162.5
[M+Na]+	439.81606	166.1
[M-H]-	415.81956	158.7
[M+NH4]+	434.86066	173.5
[M+K]+	455.79000	160.1
[M+H-H2O]+	399.82410	157.4
[M+HCOO]-	461.82504	162.1
[M+CH3COO]-	475.84069	204.0
[M+Na-2H]-	437.80151	155.8
[M]+	416.82629	161.5
[M]-	416.82739	161.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe