CID 4830

Pipamperone

Structural Information

Molecular Formula
C21H30FN3O2
SMILES
C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N
InChI
InChI=1S/C21H30FN3O2/c22-18-8-6-17(7-9-18)19(26)5-4-12-24-15-10-21(11-16-24,20(23)27)25-13-2-1-3-14-25/h6-9H,1-5,10-16H2,(H2,23,27)
InChIKey
AXKPFOAXAHJUAG-UHFFFAOYSA-N
Compound name
1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidin-1-ylpiperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

120
References

17037
Patents

375.2322 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.23948 193.3
[M+Na]+ 398.22142 193.7
[M-H]- 374.22492 195.8
[M+NH4]+ 393.26602 202.4
[M+K]+ 414.19536 189.0
[M+H-H2O]+ 358.22946 181.3
[M+HCOO]- 420.23040 203.3
[M+CH3COO]- 434.24605 219.5
[M+Na-2H]- 396.20687 190.3
[M]+ 375.23165 183.1
[M]- 375.23275 183.1
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.