CID 8022540

2-(2-chloroethoxy)propane

Structural Information

Molecular Formula
C5H11ClO
SMILES
CC(C)OCCCl
InChI
InChI=1S/C5H11ClO/c1-5(2)7-4-3-6/h5H,3-4H2,1-2H3
InChIKey
ZPEFUABIKZOZPV-UHFFFAOYSA-N
Compound name
2-(2-chloroethoxy)propane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

122.04984 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.05712 121.3
[M+Na]+ 145.03906 133.1
[M+NH4]+ 140.08366 130.5
[M+K]+ 161.01300 127.0
[M-H]- 121.04256 121.4
[M+Na-2H]- 143.02451 126.3
[M]+ 122.04929 123.2
[M]- 122.05039 123.2
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

patents stripe