CID 9568375

Nsc101488

Structural Information

Molecular Formula
C15H16N4O
SMILES
CN(C)C1=CC=C(C=C1)/C=N/NC(=O)C2=CN=CC=C2
InChI
InChI=1S/C15H16N4O/c1-19(2)14-7-5-12(6-8-14)10-17-18-15(20)13-4-3-9-16-11-13/h3-11H,1-2H3,(H,18,20)/b17-10+
InChIKey
OUIUFGWOJCNQRW-LICLKQGHSA-N
Compound name
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

268.13242 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.13970 162.0
[M+Na]+ 291.12164 167.4
[M-H]- 267.12514 169.9
[M+NH4]+ 286.16624 177.0
[M+K]+ 307.09558 165.1
[M+H-H2O]+ 251.12968 152.1
[M+HCOO]- 313.13062 189.4
[M+CH3COO]- 327.14627 209.5
[M+Na-2H]- 289.10709 168.7
[M]+ 268.13187 162.5
[M]- 268.13297 162.5
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.