CID 6072598

Nsc60312

Structural Information

Molecular Formula
C4H4F7N3
SMILES
C(=N\N)(\C(C(C(F)(F)F)(F)F)(F)F)/N
InChI
InChI=1S/C4H4F7N3/c5-2(6,1(12)14-13)3(7,8)4(9,10)11/h13H2,(H2,12,14)
InChIKey
BABBVHCTEIQUCJ-UHFFFAOYSA-N
Compound name
N'-amino-2,2,3,3,4,4,4-heptafluorobutanimidamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

227.02934 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.03662 136.3
[M+Na]+ 250.01856 143.9
[M-H]- 226.02206 128.6
[M+NH4]+ 245.06316 153.1
[M+K]+ 265.99250 142.5
[M+H-H2O]+ 210.02660 125.9
[M+HCOO]- 272.02754 150.9
[M+CH3COO]- 286.04319 196.9
[M+Na-2H]- 248.00401 140.3
[M]+ 227.02879 121.7
[M]- 227.02989 121.7
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.