CID 165990109

1-(bromomethyl)-4-fluorobicyclo[2.2.1]heptane

Structural Information

Molecular Formula
C8H12BrF
SMILES
C1CC2(CCC1(C2)CBr)F
InChI
InChI=1S/C8H12BrF/c9-6-7-1-3-8(10,5-7)4-2-7/h1-6H2
InChIKey
TUNIUTQJVHYFLB-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-4-fluorobicyclo[2.2.1]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.01064 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.01792 144.5
[M+Na]+ 228.99986 156.6
[M-H]- 205.00336 149.1
[M+NH4]+ 224.04446 175.4
[M+K]+ 244.97380 146.0
[M+H-H2O]+ 189.00790 146.5
[M+HCOO]- 251.00884 163.1
[M+CH3COO]- 265.02449 159.8
[M+Na-2H]- 226.98531 151.3
[M]+ 206.01009 160.1
[M]- 206.01119 160.1
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.