CID 13412532

Brn 5617163

Structural Information

Molecular Formula
C14H13F4N3O2
SMILES
CC(=O)N=C1C(NC(=O)N1C2=CC(=C(C=C2)F)C(F)(F)F)(C)C
InChI
InChI=1S/C14H13F4N3O2/c1-7(22)19-11-13(2,3)20-12(23)21(11)8-4-5-10(15)9(6-8)14(16,17)18/h4-6H,1-3H3,(H,20,23)
InChIKey
MTUZMNWECAUQSD-UHFFFAOYSA-N
Compound name
N-[3-[4-fluoro-3-(trifluoromethyl)phenyl]-5,5-dimethyl-2-oxoimidazolidin-4-ylidene]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.0944 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.10168 168.9
[M+Na]+ 354.08362 179.4
[M-H]- 330.08712 169.0
[M+NH4]+ 349.12822 184.3
[M+K]+ 370.05756 174.6
[M+H-H2O]+ 314.09166 159.1
[M+HCOO]- 376.09260 183.8
[M+CH3COO]- 390.10825 210.2
[M+Na-2H]- 352.06907 168.6
[M]+ 331.09385 163.4
[M]- 331.09495 163.4
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

No patent data available for this compound.