CID 10488394

3-amino-5-(trifluoromethyl)benzamide

Structural Information

Molecular Formula
C8H7F3N2O
SMILES
C1=C(C=C(C=C1C(F)(F)F)N)C(=O)N
InChI
InChI=1S/C8H7F3N2O/c9-8(10,11)5-1-4(7(13)14)2-6(12)3-5/h1-3H,12H2,(H2,13,14)
InChIKey
WOSFZFTWHRLVMV-UHFFFAOYSA-N
Compound name
3-amino-5-(trifluoromethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

204.05104 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.05832 141.8
[M+Na]+ 227.04026 149.0
[M+NH4]+ 222.08486 146.7
[M+K]+ 243.01420 145.6
[M-H]- 203.04376 139.0
[M+Na-2H]- 225.02571 145.1
[M]+ 204.05049 141.5
[M]- 204.05159 141.5
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