CID 3039026

42055-78-7

Structural Information

Molecular Formula
C15H15F3N4O2
SMILES
CN(C)C1=NC(=NC(=C1)CC(=O)NO)C2=CC(=CC=C2)C(F)(F)F
InChI
InChI=1S/C15H15F3N4O2/c1-22(2)12-7-11(8-13(23)21-24)19-14(20-12)9-4-3-5-10(6-9)15(16,17)18/h3-7,24H,8H2,1-2H3,(H,21,23)
InChIKey
LIPICLBLILGSAG-UHFFFAOYSA-N
Compound name
2-[6-(dimethylamino)-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-hydroxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.11472 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.12200 176.0
[M+Na]+ 363.10394 183.5
[M-H]- 339.10744 176.7
[M+NH4]+ 358.14854 186.2
[M+K]+ 379.07788 179.6
[M+H-H2O]+ 323.11198 164.1
[M+HCOO]- 385.11292 193.2
[M+CH3COO]- 399.12857 216.1
[M+Na-2H]- 361.08939 179.2
[M]+ 340.11417 173.1
[M]- 340.11527 173.1
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.