CID 75924

2711-20-8

Structural Information

Molecular Formula
C10H10ClF3N2O
SMILES
CN(C)C(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl
InChI
InChI=1S/C10H10ClF3N2O/c1-16(2)9(17)15-8-5-6(10(12,13)14)3-4-7(8)11/h3-5H,1-2H3,(H,15,17)
InChIKey
WPKYGXCUDANURX-UHFFFAOYSA-N
Compound name
3-[2-chloro-5-(trifluoromethyl)phenyl]-1,1-dimethylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.04337 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.05065 153.4
[M+Na]+ 289.03259 161.6
[M+NH4]+ 284.07719 158.7
[M+K]+ 305.00653 157.2
[M-H]- 265.03609 151.1
[M+Na-2H]- 287.01804 157.4
[M]+ 266.04282 153.8
[M]- 266.04392 153.8
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.