CID 206374

Brn 0691746

Structural Information

Molecular Formula
C15H15N3O3
SMILES
C1CC2=C(C1)N(C(=O)N(C2=O)C3=CC=CC=C3)CC(=O)N
InChI
InChI=1S/C15H15N3O3/c16-13(19)9-17-12-8-4-7-11(12)14(20)18(15(17)21)10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H2,16,19)
InChIKey
YJSSLUGCJRSKIQ-UHFFFAOYSA-N
Compound name
2-(2,4-dioxo-3-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.11133 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.11861 162.9
[M+Na]+ 308.10055 172.3
[M-H]- 284.10405 168.3
[M+NH4]+ 303.14515 178.3
[M+K]+ 324.07449 167.6
[M+H-H2O]+ 268.10859 154.4
[M+HCOO]- 330.10953 184.0
[M+CH3COO]- 344.12518 202.3
[M+Na-2H]- 306.08600 165.4
[M]+ 285.11078 163.0
[M]- 285.11188 163.0
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.