CID 139376

Iodomethyl methyl ether

Structural Information

Molecular Formula

SMILES

COCI

InChI

InChI=1S/C2H5IO/c1-4-2-3/h2H2,1H3

InChIKey

UUSXSNJAQDJKCG-UHFFFAOYSA-N

Compound name

iodo(methoxy)methane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 579
Patents: 171.9385 Da
Monoisotopic Mass: 0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	172.94578	117.9
[M+Na]+	194.92772	119.4
[M-H]-	170.93122	112.1
[M+NH4]+	189.97232	137.6
[M+K]+	210.90166	126.2
[M+H-H2O]+	154.93576	110.6
[M+HCOO]-	216.93670	137.8
[M+CH3COO]-	230.95235	169.8
[M+Na-2H]-	192.91317	114.3
[M]+	171.93795	116.7
[M]-	171.93905	116.7

Literature stripe

literature stripe

Patent stripe

patents stripe