CID 6870299

93726-13-7

Structural Information

Molecular Formula
C17H20N4O
SMILES
CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)C2=CC=NC=C2
InChI
InChI=1S/C17H20N4O/c1-3-21(4-2)16-7-5-14(6-8-16)13-19-20-17(22)15-9-11-18-12-10-15/h5-13H,3-4H2,1-2H3,(H,20,22)/b19-13+
InChIKey
YOXXFXCVBGSQOI-CPNJWEJPSA-N
Compound name
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3
Patents

296.1637 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.17098 171.0
[M+Na]+ 319.15292 175.5
[M-H]- 295.15642 178.5
[M+NH4]+ 314.19752 184.9
[M+K]+ 335.12686 172.8
[M+H-H2O]+ 279.16096 160.7
[M+HCOO]- 341.16190 197.7
[M+CH3COO]- 355.17755 215.5
[M+Na-2H]- 317.13837 176.7
[M]+ 296.16315 172.2
[M]- 296.16425 172.2
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

patents stripe