CID 3023914

6-methoxy-n-methyl-3-nitropyridin-2-amine

Structural Information

Molecular Formula
C7H9N3O3
SMILES
CNC1=C(C=CC(=N1)OC)[N+](=O)[O-]
InChI
InChI=1S/C7H9N3O3/c1-8-7-5(10(11)12)3-4-6(9-7)13-2/h3-4H,1-2H3,(H,8,9)
InChIKey
RSFNGZVULJTWHW-UHFFFAOYSA-N
Compound name
6-methoxy-N-methyl-3-nitropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

183.06439 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.071666 133.9
[M+Na]+ 206.053608 141.8
[M-H]- 182.057114 136.9
[M+NH4]+ 201.098213 151.6
[M+K]+ 222.027548 136.9
[M+H-H2O]+ 166.061650 131.7
[M+HCOO]- 228.062591 160.3
[M+CH3COO]- 242.078241 178.2
[M+Na-2H]- 204.039056 143.4
[M]+ 183.06384142 133.8
[M]- 183.06493858 133.8
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

patents stripe