CID 3073274

147821-54-3

Structural Information

Molecular Formula
C17H19N3O4
SMILES
CCOC(=O)C1=CN=C2N(C(CN2C1=O)C3=CC=CC=C3OC)C
InChI
InChI=1S/C17H19N3O4/c1-4-24-16(22)12-9-18-17-19(2)13(10-20(17)15(12)21)11-7-5-6-8-14(11)23-3/h5-9,13H,4,10H2,1-3H3
InChIKey
LCSRUOSREWRXOG-UHFFFAOYSA-N
Compound name
ethyl 2-(2-methoxyphenyl)-1-methyl-5-oxo-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.13754 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.14482 176.4
[M+Na]+ 352.12676 186.2
[M-H]- 328.13026 180.8
[M+NH4]+ 347.17136 189.4
[M+K]+ 368.10070 182.5
[M+H-H2O]+ 312.13480 167.0
[M+HCOO]- 374.13574 194.8
[M+CH3COO]- 388.15139 209.9
[M+Na-2H]- 350.11221 177.4
[M]+ 329.13699 181.6
[M]- 329.13809 181.6
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.