CID 208787

Urea, 1-(2-fluoroethyl)-3-nitro-

Structural Information

Molecular Formula
C3H6FN3O3
SMILES
C(CF)NC(=O)N[N+](=O)[O-]
InChI
InChI=1S/C3H6FN3O3/c4-1-2-5-3(8)6-7(9)10/h1-2H2,(H2,5,6,8)
InChIKey
XAOCRUPQPXSJEN-UHFFFAOYSA-N
Compound name
1-(2-fluoroethyl)-3-nitrourea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.03932 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.04660 122.2
[M+Na]+ 174.02854 129.8
[M+NH4]+ 169.07314 128.1
[M+K]+ 190.00248 129.3
[M-H]- 150.03204 121.3
[M+Na-2H]- 172.01399 124.9
[M]+ 151.03877 122.3
[M]- 151.03987 122.3
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.