CID 100272

64467-24-9

Structural Information

Molecular Formula
C15H18N4O4
SMILES
CCOC1=CC=C(C=C1)NC(=O)C2=C(N(C(=O)N(C2=O)C)C)N
InChI
InChI=1S/C15H18N4O4/c1-4-23-10-7-5-9(6-8-10)17-13(20)11-12(16)18(2)15(22)19(3)14(11)21/h5-8H,4,16H2,1-3H3,(H,17,20)
InChIKey
QROIEDIHRKNSQH-UHFFFAOYSA-N
Compound name
4-amino-N-(4-ethoxyphenyl)-1,3-dimethyl-2,6-dioxopyrimidine-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.1328 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.14008 173.1
[M+Na]+ 341.12202 183.1
[M-H]- 317.12552 178.2
[M+NH4]+ 336.16662 184.6
[M+K]+ 357.09596 179.5
[M+H-H2O]+ 301.13006 163.7
[M+HCOO]- 363.13100 196.1
[M+CH3COO]- 377.14665 214.0
[M+Na-2H]- 339.10747 175.0
[M]+ 318.13225 176.3
[M]- 318.13335 176.3
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.