CID 3430779

1-iodo-2-(2-iodoethoxy)ethane

Structural Information

Molecular Formula
C4H8I2O
SMILES
C(CI)OCCI
InChI
InChI=1S/C4H8I2O/c5-1-3-7-4-2-6/h1-4H2
InChIKey
XWYDQETVMJZUOJ-UHFFFAOYSA-N
Compound name
1-iodo-2-(2-iodoethoxy)ethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

497
Patents

325.86646 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.87374 135.6
[M+Na]+ 348.85568 128.7
[M-H]- 324.85918 124.9
[M+NH4]+ 343.90028 146.9
[M+K]+ 364.82962 140.2
[M+H-H2O]+ 308.86372 125.3
[M+HCOO]- 370.86466 148.0
[M+CH3COO]- 384.88031 194.5
[M+Na-2H]- 346.84113 124.4
[M]+ 325.86591 132.8
[M]- 325.86701 132.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe