CID 11483316

2,2-diiodopropane

Structural Information

Molecular Formula

C₃H₆I₂

SMILES

CC(C)(I)I

InChI

InChI=1S/C3H6I2/c1-3(2,4)5/h1-2H3

InChIKey

AZUCPFMKPGFGTB-UHFFFAOYSA-N

Compound name

2,2-diiodopropane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 789
Patents: 295.8559 Da
Monoisotopic Mass: 2.9
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]+	296.86318	125.0
[M+Na]+	318.84512	120.8
[M+NH4]+	313.88972	124.9
[M+K]+	334.81906	123.3
[M-H]-	294.84862	113.5
[M+Na-2H]-	316.83057	109.8
[M]+	295.85535	119.2
[M]-	295.85645	119.2

Literature stripe

literature stripe

Patent stripe

patents stripe