CID 137242

1871-72-3

Structural Information

Molecular Formula
C3H6BrF
SMILES
CC(CBr)F
InChI
InChI=1S/C3H6BrF/c1-3(5)2-4/h3H,2H2,1H3
InChIKey
DFMOYZCKOYEADZ-UHFFFAOYSA-N
Compound name
1-bromo-2-fluoropropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4360
Patents

139.96368 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.970956 120.1
[M+Na]+ 162.952898 131.9
[M-H]- 138.956404 122.5
[M+NH4]+ 157.997503 145.3
[M+K]+ 178.926838 122.7
[M+H-H2O]+ 122.960940 120.9
[M+HCOO]- 184.961881 140.4
[M+CH3COO]- 198.977531 173.2
[M+Na-2H]- 160.938346 128.1
[M]+ 139.96313142 136.9
[M]- 139.96422858 136.9
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