CID 5355657

15367-19-8

Structural Information

Molecular Formula
C12H10N4O2
SMILES
C1=CC=C(C=C1)/C=N\NC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C12H10N4O2/c17-16(18)11-6-7-12(13-9-11)15-14-8-10-4-2-1-3-5-10/h1-9H,(H,13,15)/b14-8-
InChIKey
HYMCGZSZXVKXNM-ZSOIEALJSA-N
Compound name
N-[(Z)-benzylideneamino]-5-nitropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.08037 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.08765 150.5
[M+Na]+ 265.06959 164.5
[M+NH4]+ 260.11419 158.4
[M+K]+ 281.04353 159.7
[M-H]- 241.07309 157.0
[M+Na-2H]- 263.05504 160.7
[M]+ 242.07982 154.1
[M]- 242.08092 154.1
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.