CID 3588852

763125-61-7

Structural Information

Molecular Formula
C20H24FN3O
SMILES
CCC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)F
InChI
InChI=1S/C20H24FN3O/c1-2-16-3-7-18(8-4-16)22-20(25)15-23-11-13-24(14-12-23)19-9-5-17(21)6-10-19/h3-10H,2,11-15H2,1H3,(H,22,25)
InChIKey
QZNWCXBCJLUOHI-UHFFFAOYSA-N
Compound name
N-(4-ethylphenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

341.19034 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.19762 183.6
[M+Na]+ 364.17956 187.7
[M-H]- 340.18306 188.0
[M+NH4]+ 359.22416 193.2
[M+K]+ 380.15350 181.7
[M+H-H2O]+ 324.18760 171.4
[M+HCOO]- 386.18854 199.5
[M+CH3COO]- 400.20419 214.7
[M+Na-2H]- 362.16501 184.4
[M]+ 341.18979 178.1
[M]- 341.19089 178.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.