CID 2737457

2-(2-fluorophenoxy)-3-nitropyridine

Structural Information

Molecular Formula
C11H7FN2O3
SMILES
C1=CC=C(C(=C1)OC2=C(C=CC=N2)[N+](=O)[O-])F
InChI
InChI=1S/C11H7FN2O3/c12-8-4-1-2-6-10(8)17-11-9(14(15)16)5-3-7-13-11/h1-7H
InChIKey
BWWQVVFSTXRVGB-UHFFFAOYSA-N
Compound name
2-(2-fluorophenoxy)-3-nitropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

1
Patents

234.04407 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.05135 145.6
[M+Na]+ 257.03329 153.7
[M-H]- 233.03679 150.2
[M+NH4]+ 252.07789 160.9
[M+K]+ 273.00723 146.7
[M+H-H2O]+ 217.04133 141.1
[M+HCOO]- 279.04227 169.8
[M+CH3COO]- 293.05792 184.1
[M+Na-2H]- 255.01874 154.4
[M]+ 234.04352 144.0
[M]- 234.04462 144.0
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.