CID 17138990

(2-iodoethyl)(methyl)amine hydroiodide

Structural Information

Molecular Formula
C3H8IN
SMILES
CNCCI
InChI
InChI=1S/C3H8IN/c1-5-3-2-4/h5H,2-3H2,1H3
InChIKey
NCBOOWSTLLAGKM-UHFFFAOYSA-N
Compound name
2-iodo-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

184.97015 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.97743 125.7
[M+Na]+ 207.95937 126.0
[M-H]- 183.96287 119.6
[M+NH4]+ 203.00397 144.5
[M+K]+ 223.93331 131.9
[M+H-H2O]+ 167.96741 117.7
[M+HCOO]- 229.96835 145.9
[M+CH3COO]- 243.98400 175.2
[M+Na-2H]- 205.94482 121.4
[M]+ 184.96960 122.6
[M]- 184.97070 122.6
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