CID 135393286

2-(2-iodoethyl)oxetane

Structural Information

Molecular Formula
C5H9IO
SMILES
C1COC1CCI
InChI
InChI=1S/C5H9IO/c6-3-1-5-2-4-7-5/h5H,1-4H2
InChIKey
SKWJZCJFYFPQHY-UHFFFAOYSA-N
Compound name
2-(2-iodoethyl)oxetane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

211.9698 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.97708 125.4
[M+Na]+ 234.95902 124.6
[M-H]- 210.96252 122.8
[M+NH4]+ 230.00362 136.2
[M+K]+ 250.93296 133.9
[M+H-H2O]+ 194.96706 112.8
[M+HCOO]- 256.96800 142.1
[M+CH3COO]- 270.98365 179.7
[M+Na-2H]- 232.94447 121.7
[M]+ 211.96925 131.3
[M]- 211.97035 131.3
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

patents stripe