CID 62669910

1-(2-fluorophenyl)-3-methylpiperazine

Structural Information

Molecular Formula
C11H15FN2
SMILES
CC1CN(CCN1)C2=CC=CC=C2F
InChI
InChI=1S/C11H15FN2/c1-9-8-14(7-6-13-9)11-5-3-2-4-10(11)12/h2-5,9,13H,6-8H2,1H3
InChIKey
HILRJMLNCMWXSA-UHFFFAOYSA-N
Compound name
1-(2-fluorophenyl)-3-methylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

194.12193 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.12921 143.7
[M+Na]+ 217.11115 150.0
[M-H]- 193.11465 144.3
[M+NH4]+ 212.15575 159.6
[M+K]+ 233.08509 145.7
[M+H-H2O]+ 177.11919 134.6
[M+HCOO]- 239.12013 159.5
[M+CH3COO]- 253.13578 154.5
[M+Na-2H]- 215.09660 147.8
[M]+ 194.12138 136.2
[M]- 194.12248 136.2
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

patents stripe