CID 11195933

1-methyl-7-(trifluoromethyl)-1h,2h,3h,4h-pyrido[2,3-d]pyrimidine-2,4-dione

Structural Information

Molecular Formula
C9H6F3N3O2
SMILES
CN1C2=C(C=CC(=N2)C(F)(F)F)C(=O)NC1=O
InChI
InChI=1S/C9H6F3N3O2/c1-15-6-4(7(16)14-8(15)17)2-3-5(13-6)9(10,11)12/h2-3H,1H3,(H,14,16,17)
InChIKey
XMZKZQWDROKDEO-UHFFFAOYSA-N
Compound name
1-methyl-7-(trifluoromethyl)pyrido[2,3-d]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.04121 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.04849 151.2
[M+Na]+ 268.03043 161.9
[M+NH4]+ 263.07503 154.9
[M+K]+ 284.00437 157.7
[M-H]- 244.03393 146.1
[M+Na-2H]- 266.01588 154.3
[M]+ 245.04066 150.8
[M]- 245.04176 150.8
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.