CID 11367315

O-[3-(trifluoromethyl)phenyl]hydroxylamine

Structural Information

Molecular Formula
C7H6F3NO
SMILES
C1=CC(=CC(=C1)ON)C(F)(F)F
InChI
InChI=1S/C7H6F3NO/c8-7(9,10)5-2-1-3-6(4-5)12-11/h1-4H,11H2
InChIKey
GJXWOKYFWORCHY-UHFFFAOYSA-N
Compound name
O-[3-(trifluoromethyl)phenyl]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

177.04015 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.047426 130.3
[M+Na]+ 200.029368 139.3
[M-H]- 176.032874 130.1
[M+NH4]+ 195.073973 150.1
[M+K]+ 216.003308 137.1
[M+H-H2O]+ 160.037410 122.5
[M+HCOO]- 222.038351 151.4
[M+CH3COO]- 236.054001 180.5
[M+Na-2H]- 198.014816 137.0
[M]+ 177.03960142 125.4
[M]- 177.04069858 125.4
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