CID 119030513

4-fluoro-n'-hydroxy-2-(trifluoromethyl)benzene-1-carboximidamide

Structural Information

Molecular Formula
C8H6F4N2O
SMILES
C1=CC(=C(C=C1F)C(F)(F)F)/C(=N/O)/N
InChI
InChI=1S/C8H6F4N2O/c9-4-1-2-5(7(13)14-15)6(3-4)8(10,11)12/h1-3,15H,(H2,13,14)
InChIKey
OKMSDQFYSBNVAK-UHFFFAOYSA-N
Compound name
4-fluoro-N'-hydroxy-2-(trifluoromethyl)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

222.04163 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.04891 140.6
[M+Na]+ 245.03085 149.3
[M-H]- 221.03435 139.2
[M+NH4]+ 240.07545 158.2
[M+K]+ 261.00479 146.3
[M+H-H2O]+ 205.03889 131.5
[M+HCOO]- 267.03983 160.4
[M+CH3COO]- 281.05548 191.9
[M+Na-2H]- 243.01630 144.4
[M]+ 222.04108 132.9
[M]- 222.04218 132.9
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