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]+ 286.118606 162.9
[M+Na]+ 308.100548 172.3
[M-H]- 284.104054 168.3
[M+NH4]+ 303.145153 178.3
[M+K]+ 324.074488 167.6
[M+H-H2O]+ 268.108590 154.4
[M+HCOO]- 330.109531 184.0
[M+CH3COO]- 344.125181 202.3
[M+Na-2H]- 306.085996 165.4
[M]+ 285.11078142 163.0
[M]- 285.11187858 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.