CID 3054969

Butylamine, 4-(4-piperidinophenyl)-, carbonate (3:1)

Structural Information

Molecular Formula
C15H24N2
SMILES
C1CCN(CC1)C2=CC=C(C=C2)CCCCN
InChI
InChI=1S/C15H24N2/c16-11-3-2-6-14-7-9-15(10-8-14)17-12-4-1-5-13-17/h7-10H,1-6,11-13,16H2
InChIKey
XWMFJKRCAWQHTR-UHFFFAOYSA-N
Compound name
4-(4-piperidin-1-ylphenyl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.19395 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.20123 158.2
[M+Na]+ 255.18317 169.8
[M+NH4]+ 250.22777 167.1
[M+K]+ 271.15711 161.4
[M-H]- 231.18667 163.0
[M+Na-2H]- 253.16862 165.5
[M]+ 232.19340 161.1
[M]- 232.19450 161.1
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.