CID 5045339

N,n-diethyl-4-(2-pyridyl)aniline

Structural Information

Molecular Formula
C15H18N2
SMILES
CCN(CC)C1=CC=C(C=C1)C2=CC=CC=N2
InChI
InChI=1S/C15H18N2/c1-3-17(4-2)14-10-8-13(9-11-14)15-7-5-6-12-16-15/h5-12H,3-4H2,1-2H3
InChIKey
SAQPQTKYCWAAMJ-UHFFFAOYSA-N
Compound name
N,N-diethyl-4-pyridin-2-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

584
Patents

226.147 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.15428 152.6
[M+Na]+ 249.13622 159.1
[M-H]- 225.13972 159.0
[M+NH4]+ 244.18082 169.6
[M+K]+ 265.11016 156.0
[M+H-H2O]+ 209.14426 143.8
[M+HCOO]- 271.14520 176.9
[M+CH3COO]- 285.16085 197.1
[M+Na-2H]- 247.12167 159.2
[M]+ 226.14645 153.4
[M]- 226.14755 153.4
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

patents stripe