CID 3303357

2-(trifluoromethyl)benzamidoxime

Structural Information

Molecular Formula
C8H7F3N2O
SMILES
C1=CC=C(C(=C1)C(=NO)N)C(F)(F)F
InChI
InChI=1S/C8H7F3N2O/c9-8(10,11)6-4-2-1-3-5(6)7(12)13-14/h1-4,14H,(H2,12,13)
InChIKey
PVKWCVFBDWTUAU-UHFFFAOYSA-N
Compound name
N'-hydroxy-2-(trifluoromethyl)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

117
Patents

204.05104 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.058316 137.9
[M+Na]+ 227.040258 145.7
[M-H]- 203.043764 137.6
[M+NH4]+ 222.084863 156.1
[M+K]+ 243.014198 143.1
[M+H-H2O]+ 187.048300 129.6
[M+HCOO]- 249.049241 158.9
[M+CH3COO]- 263.064891 187.8
[M+Na-2H]- 225.025706 143.1
[M]+ 204.05049142 131.1
[M]- 204.05158858 131.1
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

patents stripe