CID 9639081

868630-55-1

Structural Information

Molecular Formula
C16H13F3N2O2
SMILES
C1=CC=C(C=C1)CC(=O)N/N=C/C2=CC=C(C=C2)OC(F)(F)F
InChI
InChI=1S/C16H13F3N2O2/c17-16(18,19)23-14-8-6-13(7-9-14)11-20-21-15(22)10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H,21,22)/b20-11+
InChIKey
CUMUUNZCUWKTEI-RGVLZGJSSA-N
Compound name
2-phenyl-N-[(E)-[4-(trifluoromethoxy)phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.09293 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.10021 171.9
[M+Na]+ 345.08215 180.5
[M+NH4]+ 340.12675 176.5
[M+K]+ 361.05609 174.4
[M-H]- 321.08565 171.4
[M+Na-2H]- 343.06760 178.1
[M]+ 322.09238 172.6
[M]- 322.09348 172.6
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.