CID 18966832

1-iodo-2-methoxy-2-methylpropane

Structural Information

Molecular Formula
C5H11IO
SMILES
CC(C)(CI)OC
InChI
InChI=1S/C5H11IO/c1-5(2,4-6)7-3/h4H2,1-3H3
InChIKey
BRNXSSDLTFUQGI-UHFFFAOYSA-N
Compound name
1-iodo-2-methoxy-2-methylpropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

213.98546 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.99274 132.9
[M+Na]+ 236.97468 133.8
[M-H]- 212.97818 126.9
[M+NH4]+ 232.01928 151.2
[M+K]+ 252.94862 140.1
[M+H-H2O]+ 196.98272 125.6
[M+HCOO]- 258.98366 150.4
[M+CH3COO]- 272.99931 178.7
[M+Na-2H]- 234.96013 128.2
[M]+ 213.98491 132.3
[M]- 213.98601 132.3
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