CID 64939195

2411199-70-5

Structural Information

Molecular Formula
C11H14BrFN2
SMILES
CC1CNCCN1C2=C(C=C(C=C2)Br)F
InChI
InChI=1S/C11H14BrFN2/c1-8-7-14-4-5-15(8)11-3-2-9(12)6-10(11)13/h2-3,6,8,14H,4-5,7H2,1H3
InChIKey
XDHFPYZULZXDQG-UHFFFAOYSA-N
Compound name
1-(4-bromo-2-fluorophenyl)-2-methylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.03244 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.03972 157.5
[M+Na]+ 295.02166 160.7
[M+NH4]+ 290.06626 161.7
[M+K]+ 310.99560 159.5
[M-H]- 271.02516 157.7
[M+Na-2H]- 293.00711 160.4
[M]+ 272.03189 156.7
[M]- 272.03299 156.7
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.