CID 89108167

1-(2-iodoethyl)-1-methylcyclopropane

Structural Information

Molecular Formula
C6H11I
SMILES
CC1(CC1)CCI
InChI
InChI=1S/C6H11I/c1-6(2-3-6)4-5-7/h2-5H2,1H3
InChIKey
MNCIURSBKLEJBM-UHFFFAOYSA-N
Compound name
1-(2-iodoethyl)-1-methylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

209.99055 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.99783 129.1
[M+Na]+ 232.97977 131.8
[M-H]- 208.98327 127.5
[M+NH4]+ 228.02437 144.6
[M+K]+ 248.95371 136.8
[M+H-H2O]+ 192.98781 121.3
[M+HCOO]- 254.98875 147.8
[M+CH3COO]- 269.00440 181.0
[M+Na-2H]- 230.96522 125.7
[M]+ 209.99000 129.4
[M]- 209.99110 129.4
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