CID 3072201

141234-45-9

Structural Information

Molecular Formula
C16H17N3O3
SMILES
CCOC(=O)C1=CN=C2N(C(CN2C1=O)C3=CC=CC=C3)C
InChI
InChI=1S/C16H17N3O3/c1-3-22-15(21)12-9-17-16-18(2)13(10-19(16)14(12)20)11-7-5-4-6-8-11/h4-9,13H,3,10H2,1-2H3
InChIKey
MOTPHZGSXYGCEL-UHFFFAOYSA-N
Compound name
ethyl 1-methyl-5-oxo-2-phenyl-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.12698 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.13426 169.1
[M+Na]+ 322.11620 182.7
[M+NH4]+ 317.16080 175.4
[M+K]+ 338.09014 178.4
[M-H]- 298.11970 170.7
[M+Na-2H]- 320.10165 174.6
[M]+ 299.12643 171.3
[M]- 299.12753 171.3
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.