CID 66602

Iodol

Structural Information

Molecular Formula
C4HI4N
SMILES
C1(=C(NC(=C1I)I)I)I
InChI
InChI=1S/C4HI4N/c5-1-2(6)4(8)9-3(1)7/h9H
InChIKey
VJOVAKSZILJDBB-UHFFFAOYSA-N
Compound name
2,3,4,5-tetraiodo-1H-pyrrole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

280
Patents

570.6288 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 571.63608 162.8
[M+Na]+ 593.61802 151.3
[M+NH4]+ 588.66262 157.5
[M+K]+ 609.59196 157.6
[M-H]- 569.62152 150.2
[M+Na-2H]- 591.60347 148.9
[M]+ 570.62825 155.5
[M]- 570.62935 155.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.