CID 6254768

O-anisaldehyde, (5-nitro-2-pyridyl)hydrazone

Structural Information

Molecular Formula
C13H12N4O3
SMILES
COC1=CC=CC=C1/C=N\NC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C13H12N4O3/c1-20-12-5-3-2-4-10(12)8-15-16-13-7-6-11(9-14-13)17(18)19/h2-9H,1H3,(H,14,16)/b15-8-
InChIKey
XXVYWFBEVMZBQI-NVNXTCNLSA-N
Compound name
N-[(Z)-(2-methoxyphenyl)methylideneamino]-5-nitropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.09094 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.098216 157.3
[M+Na]+ 295.080158 163.3
[M-H]- 271.083664 164.2
[M+NH4]+ 290.124763 171.0
[M+K]+ 311.054098 156.5
[M+H-H2O]+ 255.088200 152.3
[M+HCOO]- 317.089141 185.6
[M+CH3COO]- 331.104791 198.2
[M+Na-2H]- 293.065606 167.3
[M]+ 272.09039142 156.9
[M]- 272.09148858 156.9
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.