CID 135765143

1-methyl-4-(trifluoroacetyl)pyridinium chloride oxime

Structural Information

Molecular Formula
C8H8F3N2O
SMILES
C[N+]1=CC=C(C=C1)/C(=N/O)/C(F)(F)F
InChI
InChI=1S/C8H7F3N2O/c1-13-4-2-6(3-5-13)7(12-14)8(9,10)11/h2-5H,1H3/p+1
InChIKey
FNPDWAPDSLYLMC-UHFFFAOYSA-O
Compound name
(NZ)-N-[2,2,2-trifluoro-1-(1-methylpyridin-1-ium-4-yl)ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.05887 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.06615 137.2
[M+Na]+ 228.04809 147.5
[M+NH4]+ 223.09269 143.2
[M+K]+ 244.02203 144.1
[M-H]- 204.05159 135.4
[M+Na-2H]- 226.03354 142.7
[M]+ 205.05832 138.1
[M]- 205.05942 138.1
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.