CID 24843851

Propiophenone, 4'-amino-3-piperidino-, monohydrochloride

Structural Information

Molecular Formula
C14H20N2O
SMILES
C1CCN(CC1)CCC(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C14H20N2O/c15-13-6-4-12(5-7-13)14(17)8-11-16-9-2-1-3-10-16/h4-7H,1-3,8-11,15H2
InChIKey
ALLVSPQJVPCNPD-UHFFFAOYSA-N
Compound name
1-(4-aminophenyl)-3-piperidin-1-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.15756 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.16484 155.3
[M+Na]+ 255.14678 158.9
[M-H]- 231.15028 158.9
[M+NH4]+ 250.19138 170.7
[M+K]+ 271.12072 155.4
[M+H-H2O]+ 215.15482 146.9
[M+HCOO]- 277.15576 173.9
[M+CH3COO]- 291.17141 193.1
[M+Na-2H]- 253.13223 157.9
[M]+ 232.15701 149.4
[M]- 232.15811 149.4
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.