CID 7010338

2-(2-methoxyethoxy)acetyl chloride

Structural Information

Molecular Formula
C5H9ClO3
SMILES
COCCOCC(=O)Cl
InChI
InChI=1S/C5H9ClO3/c1-8-2-3-9-4-5(6)7/h2-4H2,1H3
InChIKey
OZJZCCMIOZPPIT-UHFFFAOYSA-N
Compound name
2-(2-methoxyethoxy)acetyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

565
Patents

152.02402 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.03130 126.5
[M+Na]+ 175.01324 134.9
[M-H]- 151.01674 126.9
[M+NH4]+ 170.05784 148.5
[M+K]+ 190.98718 134.1
[M+H-H2O]+ 135.02128 123.0
[M+HCOO]- 197.02222 146.1
[M+CH3COO]- 211.03787 173.9
[M+Na-2H]- 172.99869 132.6
[M]+ 152.02347 132.2
[M]- 152.02457 132.2
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