CID 98816

3-pyridinecarboxamide, n,n-diethyl-5-phenyl-

Structural Information

Molecular Formula
C16H18N2O
SMILES
CCN(CC)C(=O)C1=CN=CC(=C1)C2=CC=CC=C2
InChI
InChI=1S/C16H18N2O/c1-3-18(4-2)16(19)15-10-14(11-17-12-15)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3
InChIKey
UMBKIZJZONTRIS-UHFFFAOYSA-N
Compound name
N,N-diethyl-5-phenylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.1419 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.14918 160.1
[M+Na]+ 277.13112 174.0
[M+NH4]+ 272.17572 168.4
[M+K]+ 293.10506 166.4
[M-H]- 253.13462 165.0
[M+Na-2H]- 275.11657 169.7
[M]+ 254.14135 163.5
[M]- 254.14245 163.5
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.