CID 119008598

2-methoxy-6-(trifluoromethoxy)aniline hydrochloride

Structural Information

Molecular Formula
C8H8F3NO2
SMILES
COC1=C(C(=CC=C1)OC(F)(F)F)N
InChI
InChI=1S/C8H8F3NO2/c1-13-5-3-2-4-6(7(5)12)14-8(9,10)11/h2-4H,12H2,1H3
InChIKey
KGZGRXLFOGQTLL-UHFFFAOYSA-N
Compound name
2-methoxy-6-(trifluoromethoxy)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.05072 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.05800 143.9
[M+Na]+ 230.03994 152.4
[M+NH4]+ 225.08454 149.2
[M+K]+ 246.01388 148.0
[M-H]- 206.04344 141.0
[M+Na-2H]- 228.02539 147.7
[M]+ 207.05017 143.9
[M]- 207.05127 143.9
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

No patent data available for this compound.