CID 71344094

(3,3,4,4,5,5,6,6,6-nonafluorohexyl)carbonimidoyl

Structural Information

Molecular Formula
C7H4Cl2F9N
SMILES
C(CN=C(Cl)Cl)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C7H4Cl2F9N/c8-3(9)19-2-1-4(10,11)5(12,13)6(14,15)7(16,17)18/h1-2H2
InChIKey
KHEZQPBUHOLTCH-UHFFFAOYSA-N
Compound name
1,1-dichloro-N-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)methanimine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

342.9577 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.96498 155.3
[M+Na]+ 365.94692 165.0
[M-H]- 341.95042 146.1
[M+NH4]+ 360.99152 170.0
[M+K]+ 381.92086 159.3
[M+H-H2O]+ 325.95496 145.3
[M+HCOO]- 387.95590 155.9
[M+CH3COO]- 401.97155 211.6
[M+Na-2H]- 363.93237 158.5
[M]+ 342.95715 145.6
[M]- 342.95825 145.6
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.