CID 3058440

75273-94-8

Structural Information

Molecular Formula
C13H11N3O3
SMILES
COC1=C(C=CC(=C1)[N+](=O)[O-])N=CC2=CC=NC=C2
InChI
InChI=1S/C13H11N3O3/c1-19-13-8-11(16(17)18)2-3-12(13)15-9-10-4-6-14-7-5-10/h2-9H,1H3
InChIKey
KKTPOHVCUDRPPV-UHFFFAOYSA-N
Compound name
N-(2-methoxy-4-nitrophenyl)-1-pyridin-4-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.08005 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.08733 154.7
[M+Na]+ 280.06927 169.7
[M+NH4]+ 275.11387 162.4
[M+K]+ 296.04321 164.9
[M-H]- 256.07277 160.5
[M+Na-2H]- 278.05472 164.2
[M]+ 257.07950 158.3
[M]- 257.08060 158.3
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.