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

44
Patents

213.98546 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.992736 132.9
[M+Na]+ 236.974678 133.8
[M-H]- 212.978184 126.9
[M+NH4]+ 232.019283 151.2
[M+K]+ 252.948618 140.1
[M+H-H2O]+ 196.982720 125.6
[M+HCOO]- 258.983661 150.4
[M+CH3COO]- 272.999311 178.7
[M+Na-2H]- 234.960126 128.2
[M]+ 213.98491142 132.3
[M]- 213.98600858 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