CID 134937082

1-bromo-3-chloro-2-(methoxymethoxy)propane

Structural Information

Molecular Formula
C5H10BrClO2
SMILES
COCOC(CCl)CBr
InChI
InChI=1S/C5H10BrClO2/c1-8-4-9-5(2-6)3-7/h5H,2-4H2,1H3
InChIKey
HPVNOGJSONQOIO-UHFFFAOYSA-N
Compound name
1-bromo-3-chloro-2-(methoxymethoxy)propane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.95528 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.96256 136.5
[M+Na]+ 238.94450 138.6
[M+NH4]+ 233.98910 141.2
[M+K]+ 254.91844 138.7
[M-H]- 214.94800 134.7
[M+Na-2H]- 236.92995 137.7
[M]+ 215.95473 135.2
[M]- 215.95583 135.2
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

No patent data available for this compound.