CID 89728

22483-09-6

Structural Information

Molecular Formula
C4H11NO2
SMILES
COC(CN)OC
InChI
InChI=1S/C4H11NO2/c1-6-4(3-5)7-2/h4H,3,5H2,1-2H3
InChIKey
QKWWDTYDYOFRJL-UHFFFAOYSA-N
Compound name
2,2-dimethoxyethanamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

3
References

10248
Patents

105.07898 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.086256 120.6
[M+Na]+ 128.068198 127.5
[M-H]- 104.071704 120.7
[M+NH4]+ 123.112803 143.2
[M+K]+ 144.042138 128.8
[M+H-H2O]+ 88.076240 115.9
[M+HCOO]- 150.077181 144.9
[M+CH3COO]- 164.092831 170.0
[M+Na-2H]- 126.053646 126.6
[M]+ 105.07843142 121.5
[M]- 105.07952858 121.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe