CID 62478380

1-(5-fluoropyridin-2-yl)-3-methylpiperazine

Structural Information

Molecular Formula
C10H14FN3
SMILES
CC1CN(CCN1)C2=NC=C(C=C2)F
InChI
InChI=1S/C10H14FN3/c1-8-7-14(5-4-12-8)10-3-2-9(11)6-13-10/h2-3,6,8,12H,4-5,7H2,1H3
InChIKey
LLWNNOFESZDJJZ-UHFFFAOYSA-N
Compound name
1-(5-fluoropyridin-2-yl)-3-methylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

195.11717 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.12445 145.0
[M+Na]+ 218.10639 157.4
[M+NH4]+ 213.15099 152.4
[M+K]+ 234.08033 150.6
[M-H]- 194.10989 146.0
[M+Na-2H]- 216.09184 151.6
[M]+ 195.11662 146.8
[M]- 195.11772 146.8
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