CID 78071

2-(2-chloroethyl)-1,3-dioxolane

Structural Information

Molecular Formula
C5H9ClO2
SMILES
C1COC(O1)CCCl
InChI
InChI=1S/C5H9ClO2/c6-2-1-5-7-3-4-8-5/h5H,1-4H2
InChIKey
GBKZPLIJKMRYTE-UHFFFAOYSA-N
Compound name
2-(2-chloroethyl)-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

93
Patents

136.02911 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.036386 125.5
[M+Na]+ 159.018328 133.1
[M-H]- 135.021834 129.7
[M+NH4]+ 154.062933 147.0
[M+K]+ 174.992268 133.5
[M+H-H2O]+ 119.026370 121.6
[M+HCOO]- 181.027311 142.9
[M+CH3COO]- 195.042961 168.1
[M+Na-2H]- 157.003776 132.8
[M]+ 136.02856142 127.4
[M]- 136.02965858 127.4
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

No patent data available for this compound.