CID 10964431

1-(chloromethoxy)propane

Structural Information

Molecular Formula
C4H9ClO
SMILES
CCCOCCl
InChI
InChI=1S/C4H9ClO/c1-2-3-6-4-5/h2-4H2,1H3
InChIKey
VHUQXPJHMISKGS-UHFFFAOYSA-N
Compound name
1-(chloromethoxy)propane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

253
Patents

108.034195 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 109.04147 116.3
[M+Na]+ 131.02341 128.7
[M+NH4]+ 126.06802 125.8
[M+K]+ 146.99735 122.0
[M-H]- 107.02692 116.7
[M+Na-2H]- 129.00886 121.9
[M]+ 108.03365 118.4
[M]- 108.03474 118.4
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