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]+ 319.140076 173.1
[M+Na]+ 341.122018 183.1
[M-H]- 317.125524 178.2
[M+NH4]+ 336.166623 184.6
[M+K]+ 357.095958 179.5
[M+H-H2O]+ 301.130060 163.7
[M+HCOO]- 363.131001 196.1
[M+CH3COO]- 377.146651 214.0
[M+Na-2H]- 339.107466 175.0
[M]+ 318.13225142 176.3
[M]- 318.13334858 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.