CID 202127

7542-72-5

Structural Information

Molecular Formula
C13H19FN2O
SMILES
CN1CCN(CC1)C(CO)C2=CC=C(C=C2)F
InChI
InChI=1S/C13H19FN2O/c1-15-6-8-16(9-7-15)13(10-17)11-2-4-12(14)5-3-11/h2-5,13,17H,6-10H2,1H3
InChIKey
JOKWMUGHPGVPGY-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.14815 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15543 157.2
[M+Na]+ 261.13737 168.4
[M+NH4]+ 256.18197 164.2
[M+K]+ 277.11131 162.0
[M-H]- 237.14087 158.3
[M+Na-2H]- 259.12282 162.7
[M]+ 238.14760 158.8
[M]- 238.14870 158.8
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

No patent data available for this compound.