CID 3043223

Brn 0653695

Structural Information

Molecular Formula
C10H13N3O2
SMILES
CCCCN1C(=O)C2=C(C=CN2)NC1=O
InChI
InChI=1S/C10H13N3O2/c1-2-3-6-13-9(14)8-7(4-5-11-8)12-10(13)15/h4-5,11H,2-3,6H2,1H3,(H,12,15)
InChIKey
OWJRKRZXCAMPBO-UHFFFAOYSA-N
Compound name
3-butyl-1,5-dihydropyrrolo[3,2-d]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.10077 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.10805 144.2
[M+Na]+ 230.08999 157.3
[M+NH4]+ 225.13459 150.4
[M+K]+ 246.06393 153.3
[M-H]- 206.09349 143.0
[M+Na-2H]- 228.07544 148.6
[M]+ 207.10022 145.5
[M]- 207.10132 145.5
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.