CID 135483806

Inh deriv.

Structural Information

Molecular Formula
C16H15N3O2
SMILES
C=CCC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=NC=C2)O
InChI
InChI=1S/C16H15N3O2/c1-2-3-14-10-12(4-5-15(14)20)11-18-19-16(21)13-6-8-17-9-7-13/h2,4-11,20H,1,3H2,(H,19,21)/b18-11+
InChIKey
RMNIYZRQKZGBPM-WOJGMQOQSA-N
Compound name
N-[(E)-(4-hydroxy-3-prop-2-enylphenyl)methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.11642 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.12370 164.9
[M+Na]+ 304.10564 171.4
[M-H]- 280.10914 170.3
[M+NH4]+ 299.15024 178.6
[M+K]+ 320.07958 166.6
[M+H-H2O]+ 264.11368 155.8
[M+HCOO]- 326.11462 189.4
[M+CH3COO]- 340.13027 204.2
[M+Na-2H]- 302.09109 170.3
[M]+ 281.11587 164.5
[M]- 281.11697 164.5
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.