CID 210482

21263-31-0

Structural Information

Molecular Formula
C23H29FN2O2
SMILES
CCOC(CC1=CC=CC=C1)N2CCN(CC2)CCC(=O)C3=CC=C(C=C3)F
InChI
InChI=1S/C23H29FN2O2/c1-2-28-23(18-19-6-4-3-5-7-19)26-16-14-25(15-17-26)13-12-22(27)20-8-10-21(24)11-9-20/h3-11,23H,2,12-18H2,1H3
InChIKey
BPKZCYWPGGHWCJ-UHFFFAOYSA-N
Compound name
3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-(4-fluorophenyl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.2213 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.22858 197.4
[M+Na]+ 407.21052 209.1
[M+NH4]+ 402.25512 203.3
[M+K]+ 423.18446 201.0
[M-H]- 383.21402 200.5
[M+Na-2H]- 405.19597 204.1
[M]+ 384.22075 199.8
[M]- 384.22185 199.8
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.