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

0
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

literature stripe

Patent stripe

patents stripe