CID 21559954

1-(bromomethyl)-1-fluorocyclopropane

Structural Information

Molecular Formula
C4H6BrF
SMILES
C1CC1(CBr)F
InChI
InChI=1S/C4H6BrF/c5-3-4(6)1-2-4/h1-3H2
InChIKey
LQVPKSHJUGOHPN-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-1-fluorocyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

151.96368 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.97096 122.2
[M+Na]+ 174.95290 136.2
[M-H]- 150.95640 128.9
[M+NH4]+ 169.99750 144.1
[M+K]+ 190.92684 126.7
[M+H-H2O]+ 134.96094 122.8
[M+HCOO]- 196.96188 143.4
[M+CH3COO]- 210.97753 177.0
[M+Na-2H]- 172.93835 132.3
[M]+ 151.96313 140.9
[M]- 151.96423 140.9
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