CID 129922426

1-(bromomethyl)-1-chlorocyclopropane

Structural Information

Molecular Formula
C4H6BrCl
SMILES
C1CC1(CBr)Cl
InChI
InChI=1S/C4H6BrCl/c5-3-4(6)1-2-4/h1-3H2
InChIKey
CJSWRUBKMFZEGP-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-1-chlorocyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.93414 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.94142 122.9
[M+Na]+ 190.92336 137.6
[M-H]- 166.92686 130.5
[M+NH4]+ 185.96796 145.0
[M+K]+ 206.89730 126.6
[M+H-H2O]+ 150.93140 125.1
[M+HCOO]- 212.93234 140.8
[M+CH3COO]- 226.94799 178.0
[M+Na-2H]- 188.90881 133.3
[M]+ 167.93359 144.0
[M]- 167.93469 144.0
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.