CID 16484703

2-(2,2,3,3,4,4,4-heptafluorobutanoyl)hydrazine-1-carboximidamide

Structural Information

Molecular Formula
C5H5F7N4O
SMILES
C(=O)(C(C(C(F)(F)F)(F)F)(F)F)NN=C(N)N
InChI
InChI=1S/C5H5F7N4O/c6-3(7,1(17)15-16-2(13)14)4(8,9)5(10,11)12/h(H,15,17)(H4,13,14,16)
InChIKey
UROJGTAWXQQYQK-UHFFFAOYSA-N
Compound name
N-(diaminomethylideneamino)-2,2,3,3,4,4,4-heptafluorobutanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

270.03516 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.04244 144.6
[M+Na]+ 293.02438 151.1
[M-H]- 269.02788 136.8
[M+NH4]+ 288.06898 159.2
[M+K]+ 308.99832 150.0
[M+H-H2O]+ 253.03242 133.7
[M+HCOO]- 315.03336 159.4
[M+CH3COO]- 329.04901 206.2
[M+Na-2H]- 291.00983 147.7
[M]+ 270.03461 129.7
[M]- 270.03571 129.7
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.