CID 855055

6-amino-1,3-dipropyluracil

Structural Information

Molecular Formula
C10H17N3O2
SMILES
CCCN1C(=CC(=O)N(C1=O)CCC)N
InChI
InChI=1S/C10H17N3O2/c1-3-5-12-8(11)7-9(14)13(6-4-2)10(12)15/h7H,3-6,11H2,1-2H3
InChIKey
WWYIZMBRAYKRFU-UHFFFAOYSA-N
Compound name
6-amino-1,3-dipropylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

105
Patents

211.13208 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.13936 146.3
[M+Na]+ 234.12130 156.7
[M-H]- 210.12480 147.7
[M+NH4]+ 229.16590 162.9
[M+K]+ 250.09524 153.6
[M+H-H2O]+ 194.12934 139.0
[M+HCOO]- 256.13028 169.1
[M+CH3COO]- 270.14593 191.2
[M+Na-2H]- 232.10675 150.3
[M]+ 211.13153 148.9
[M]- 211.13263 148.9
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

patents stripe