CID 375735

Nsc655744

Structural Information

Molecular Formula
C10H13N5O2
SMILES
CCNC1=CN=C2C(=N1)C(=O)N(C(=O)N2C)C
InChI
InChI=1S/C10H13N5O2/c1-4-11-6-5-12-8-7(13-6)9(16)15(3)10(17)14(8)2/h5H,4H2,1-3H3,(H,11,13)
InChIKey
BSBFNRWYEWTDIV-UHFFFAOYSA-N
Compound name
6-(ethylamino)-1,3-dimethylpteridine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.10692 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.11420 153.4
[M+Na]+ 258.09614 166.1
[M-H]- 234.09964 154.0
[M+NH4]+ 253.14074 167.5
[M+K]+ 274.07008 161.9
[M+H-H2O]+ 218.10418 144.6
[M+HCOO]- 280.10512 173.7
[M+CH3COO]- 294.12077 196.5
[M+Na-2H]- 256.08159 160.9
[M]+ 235.10637 157.1
[M]- 235.10747 157.1
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.