CID 2777230

4-(trifluoromethoxy)benzoic acid hydrazide

Structural Information

Molecular Formula
C8H7F3N2O2
SMILES
C1=CC(=CC=C1C(=O)NN)OC(F)(F)F
InChI
InChI=1S/C8H7F3N2O2/c9-8(10,11)15-6-3-1-5(2-4-6)7(14)13-12/h1-4H,12H2,(H,13,14)
InChIKey
QWYPNGTZNFACCP-UHFFFAOYSA-N
Compound name
4-(trifluoromethoxy)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

163
Patents

220.04596 Da
Monoisotopic Mass

1.5
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

literature stripe

Patent stripe

patents stripe