CID 2363705

568555-61-3

Structural Information

Molecular Formula
C13H22N4O2
SMILES
CCCCN1C(=C(C(=O)NC1=O)NC2CCCC2)N
InChI
InChI=1S/C13H22N4O2/c1-2-3-8-17-11(14)10(12(18)16-13(17)19)15-9-6-4-5-7-9/h9,15H,2-8,14H2,1H3,(H,16,18,19)
InChIKey
QSWLLYQXNWLJDT-UHFFFAOYSA-N
Compound name
6-amino-1-butyl-5-(cyclopentylamino)pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.1743 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.18158 162.3
[M+Na]+ 289.16352 171.1
[M+NH4]+ 284.20812 167.6
[M+K]+ 305.13746 168.0
[M-H]- 265.16702 163.8
[M+Na-2H]- 287.14897 165.8
[M]+ 266.17375 163.4
[M]- 266.17485 163.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.