CID 96623

Methoxyacetyl chloride

Structural Information

Molecular Formula
C3H5ClO2
SMILES
COCC(=O)Cl
InChI
InChI=1S/C3H5ClO2/c1-6-2-3(4)5/h2H2,1H3
InChIKey
JJKWHOSQTYYFAE-UHFFFAOYSA-N
Compound name
2-methoxyacetyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

10425
Patents

107.99781 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 109.00509 114.6
[M+Na]+ 130.98703 126.3
[M+NH4]+ 126.03163 123.2
[M+K]+ 146.96097 121.1
[M-H]- 106.99053 113.9
[M+Na-2H]- 128.97248 119.4
[M]+ 107.99726 116.1
[M]- 107.99836 116.1
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