CID 21916360

5,6-diamino-1-ethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

Structural Information

Molecular Formula
C6H10N4O2
SMILES
CCN1C(=C(C(=O)NC1=O)N)N
InChI
InChI=1S/C6H10N4O2/c1-2-10-4(8)3(7)5(11)9-6(10)12/h2,7-8H2,1H3,(H,9,11,12)
InChIKey
HEXZSEOAILCDMD-UHFFFAOYSA-N
Compound name
5,6-diamino-1-ethylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

112
Patents

170.08037 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.08765 134.2
[M+Na]+ 193.06959 145.1
[M-H]- 169.07309 134.4
[M+NH4]+ 188.11419 151.1
[M+K]+ 209.04353 141.6
[M+H-H2O]+ 153.07763 127.5
[M+HCOO]- 215.07857 157.1
[M+CH3COO]- 229.09422 181.3
[M+Na-2H]- 191.05504 139.0
[M]+ 170.07982 131.7
[M]- 170.08092 131.7
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

patents stripe