CID 9576144

28058-23-3

Structural Information

Molecular Formula
C14H12N4O2
SMILES
C1=CC=C(C=C1)/C=C\C=N\NC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C14H12N4O2/c19-18(20)13-8-9-14(15-11-13)17-16-10-4-7-12-5-2-1-3-6-12/h1-11H,(H,15,17)/b7-4-,16-10+
InChIKey
OVCXYRIKVQDISR-VKZSLHGGSA-N
Compound name
5-nitro-N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.09604 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.10332 158.8
[M+Na]+ 291.08526 172.4
[M+NH4]+ 286.12986 166.1
[M+K]+ 307.05920 167.0
[M-H]- 267.08876 165.0
[M+Na-2H]- 289.07071 168.4
[M]+ 268.09549 162.2
[M]- 268.09659 162.2
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.