CID 49966143

(2-phenylethyl)[2-(pyridin-4-yl)ethyl]amine

Structural Information

Molecular Formula
C15H18N2
SMILES
C1=CC=C(C=C1)CCNCCC2=CC=NC=C2
InChI
InChI=1S/C15H18N2/c1-2-4-14(5-3-1)6-10-16-11-7-15-8-12-17-13-9-15/h1-5,8-9,12-13,16H,6-7,10-11H2
InChIKey
RYDZIKYBEVGJEF-UHFFFAOYSA-N
Compound name
2-phenyl-N-(2-pyridin-4-ylethyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.147 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.15428 152.0
[M+Na]+ 249.13622 157.3
[M-H]- 225.13972 156.5
[M+NH4]+ 244.18082 168.0
[M+K]+ 265.11016 152.8
[M+H-H2O]+ 209.14426 143.2
[M+HCOO]- 271.14520 175.8
[M+CH3COO]- 285.16085 192.6
[M+Na-2H]- 247.12167 160.2
[M]+ 226.14645 151.2
[M]- 226.14755 151.2
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.