CID 7131548

6-amino-1-cyclopropylpyrimidine-2,4(1h,3h)-dione

Structural Information

Molecular Formula
C7H9N3O2
SMILES
C1CC1N2C(=CC(=O)NC2=O)N
InChI
InChI=1S/C7H9N3O2/c8-5-3-6(11)9-7(12)10(5)4-1-2-4/h3-4H,1-2,8H2,(H,9,11,12)
InChIKey
XXNAZVMHAGMLRX-UHFFFAOYSA-N
Compound name
6-amino-1-cyclopropylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

18
Patents

167.06947 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.07675 134.9
[M+Na]+ 190.05869 148.5
[M+NH4]+ 185.10329 142.2
[M+K]+ 206.03263 145.2
[M-H]- 166.06219 143.2
[M+Na-2H]- 188.04414 143.5
[M]+ 167.06892 140.0
[M]- 167.07002 140.0
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