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

13
Patents

194.12193 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.129206 143.7
[M+Na]+ 217.111148 150.0
[M-H]- 193.114654 144.3
[M+NH4]+ 212.155753 159.6
[M+K]+ 233.085088 145.7
[M+H-H2O]+ 177.119190 134.6
[M+HCOO]- 239.120131 159.5
[M+CH3COO]- 253.135781 154.5
[M+Na-2H]- 215.096596 147.8
[M]+ 194.12138142 136.2
[M]- 194.12247858 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