CID 43491432

Ethyl[(4-ethylphenyl)(pyridin-3-yl)methyl]amine

Structural Information

Molecular Formula
C16H20N2
SMILES
CCC1=CC=C(C=C1)C(C2=CN=CC=C2)NCC
InChI
InChI=1S/C16H20N2/c1-3-13-7-9-14(10-8-13)16(18-4-2)15-6-5-11-17-12-15/h5-12,16,18H,3-4H2,1-2H3
InChIKey
ADOMPSJVIVDBKD-UHFFFAOYSA-N
Compound name
N-[(4-ethylphenyl)-pyridin-3-ylmethyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

240.16264 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.16992 158.5
[M+Na]+ 263.15186 172.6
[M+NH4]+ 258.19646 167.4
[M+K]+ 279.12580 163.9
[M-H]- 239.15536 163.8
[M+Na-2H]- 261.13731 168.3
[M]+ 240.16209 162.1
[M]- 240.16319 162.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.