CID 57296

Brn 0241720

Structural Information

Molecular Formula
C11H18N4O3
SMILES
CC1=C(C(=O)N(C(=O)N1C)C)NC(=O)CN(C)C
InChI
InChI=1S/C11H18N4O3/c1-7-9(12-8(16)6-13(2)3)10(17)15(5)11(18)14(7)4/h6H2,1-5H3,(H,12,16)
InChIKey
BEBYZFAJWKKQPG-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-N-(1,3,4-trimethyl-2,6-dioxopyrimidin-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.1379 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.14518 155.5
[M+Na]+ 277.12712 165.6
[M-H]- 253.13062 159.3
[M+NH4]+ 272.17172 171.0
[M+K]+ 293.10106 164.5
[M+H-H2O]+ 237.13516 147.8
[M+HCOO]- 299.13610 179.5
[M+CH3COO]- 313.15175 206.3
[M+Na-2H]- 275.11257 158.0
[M]+ 254.13735 160.4
[M]- 254.13845 160.4
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.