CID 3805577

374544-56-6

Structural Information

Molecular Formula
C24H14Cl2F6N2O2
SMILES
C1=CC(=CC(=C1)NC(=O)C(=CC2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C24H14Cl2F6N2O2/c25-19-8-7-13(10-20(19)26)9-18(21(35)33-16-5-1-3-14(11-16)23(27,28)29)22(36)34-17-6-2-4-15(12-17)24(30,31)32/h1-12H,(H,33,35)(H,34,36)
InChIKey
AMYPOXLQHKCQSQ-UHFFFAOYSA-N
Compound name
2-[(3,4-dichlorophenyl)methylidene]-N,N'-bis[3-(trifluoromethyl)phenyl]propanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

546.0336 Da
Monoisotopic Mass

8.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 547.04088 207.7
[M+Na]+ 569.02282 212.9
[M+NH4]+ 564.06742 208.4
[M+K]+ 584.99676 208.1
[M-H]- 545.02632 203.8
[M+Na-2H]- 567.00827 209.7
[M]+ 546.03305 207.2
[M]- 546.03415 207.2
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