CID 138395829

Hydrazinecarboxamide, n-(3,5-difluorophenyl)-

Structural Information

Molecular Formula
C7H7F2N3O
SMILES
C1=C(C=C(C=C1F)F)N(C(=O)N)N
InChI
InChI=1S/C7H7F2N3O/c8-4-1-5(9)3-6(2-4)12(11)7(10)13/h1-3H,11H2,(H2,10,13)
InChIKey
SKUVNKQHJKCNES-UHFFFAOYSA-N
Compound name
1-amino-1-(3,5-difluorophenyl)urea
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

187.05573 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.06301 135.0
[M+Na]+ 210.04495 142.9
[M-H]- 186.04845 137.2
[M+NH4]+ 205.08955 154.1
[M+K]+ 226.01889 141.6
[M+H-H2O]+ 170.05299 126.8
[M+HCOO]- 232.05393 159.8
[M+CH3COO]- 246.06958 191.5
[M+Na-2H]- 208.03040 138.3
[M]+ 187.05518 129.6
[M]- 187.05628 129.6
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.