CID 3801099

3-(trifluoromethoxy)benzohydrazide

Structural Information

Molecular Formula
C8H7F3N2O2
SMILES
C1=CC(=CC(=C1)OC(F)(F)F)C(=O)NN
InChI
InChI=1S/C8H7F3N2O2/c9-8(10,11)15-6-3-1-2-5(4-6)7(14)13-12/h1-4H,12H2,(H,13,14)
InChIKey
MNEXCWJCDZXJLF-UHFFFAOYSA-N
Compound name
3-(trifluoromethoxy)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

220.04596 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.05324 140.8
[M+Na]+ 243.03518 148.4
[M-H]- 219.03868 140.4
[M+NH4]+ 238.07978 158.2
[M+K]+ 259.00912 146.4
[M+H-H2O]+ 203.04322 132.2
[M+HCOO]- 265.04416 162.0
[M+CH3COO]- 279.05981 189.9
[M+Na-2H]- 241.02063 146.0
[M]+ 220.04541 135.4
[M]- 220.04651 135.4
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