CID 23574

Dinitrofluoromethane

Structural Information

Molecular Formula
CHFN2O4
SMILES
C([N+](=O)[O-])([N+](=O)[O-])F
InChI
InChI=1S/CHFN2O4/c2-1(3(5)6)4(7)8/h1H
InChIKey
UVWILGLWOOQUJD-UHFFFAOYSA-N
Compound name
fluoro(dinitro)methane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

123.992035 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.99931 117.2
[M+Na]+ 146.98125 124.5
[M-H]- 122.98476 116.8
[M+NH4]+ 142.02586 137.0
[M+K]+ 162.95519 117.7
[M+H-H2O]+ 106.98930 121.2
[M+HCOO]- 168.99024 142.4
[M+CH3COO]- 183.00589 159.7
[M+Na-2H]- 144.96670 126.3
[M]+ 123.99149 112.4
[M]- 123.99258 112.4
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