CID 13778344

3-(iodomethyl)-3-methyloxetane

Structural Information

Molecular Formula
C5H9IO
SMILES
CC1(COC1)CI
InChI
InChI=1S/C5H9IO/c1-5(2-6)3-7-4-5/h2-4H2,1H3
InChIKey
UAYNHSVKPDQASH-UHFFFAOYSA-N
Compound name
3-(iodomethyl)-3-methyloxetane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

205
Patents

211.9698 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.97708 123.9
[M+Na]+ 234.95902 124.1
[M+NH4]+ 230.00362 126.6
[M+K]+ 250.93296 122.4
[M-H]- 210.96252 118.2
[M+Na-2H]- 232.94447 116.7
[M]+ 211.96925 120.4
[M]- 211.97035 120.4
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