CID 3056789

Propiophenone, 4'-(2-morpholinoethoxy)-3-piperidino-, hydrochloride

Structural Information

Molecular Formula
C20H30N2O3
SMILES
C1CCN(CC1)CCC(=O)C2=CC=C(C=C2)OCCN3CCOCC3
InChI
InChI=1S/C20H30N2O3/c23-20(8-11-21-9-2-1-3-10-21)18-4-6-19(7-5-18)25-17-14-22-12-15-24-16-13-22/h4-7H,1-3,8-17H2
InChIKey
MAAGLVKUBHKUOW-UHFFFAOYSA-N
Compound name
1-[4-(2-morpholin-4-ylethoxy)phenyl]-3-piperidin-1-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.22565 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.23293 186.2
[M+Na]+ 369.21487 185.9
[M-H]- 345.21837 190.6
[M+NH4]+ 364.25947 193.6
[M+K]+ 385.18881 183.4
[M+H-H2O]+ 329.22291 174.3
[M+HCOO]- 391.22385 197.2
[M+CH3COO]- 405.23950 210.7
[M+Na-2H]- 367.20032 186.1
[M]+ 346.22510 180.8
[M]- 346.22620 180.8
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.