CID 253730

1-isopropyldihydropyrimidine-2,4(1h,3h)-dione

Structural Information

Molecular Formula
C7H12N2O2
SMILES
CC(C)N1CCC(=O)NC1=O
InChI
InChI=1S/C7H12N2O2/c1-5(2)9-4-3-6(10)8-7(9)11/h5H,3-4H2,1-2H3,(H,8,10,11)
InChIKey
UUTAKONPWRIWRH-UHFFFAOYSA-N
Compound name
1-propan-2-yl-1,3-diazinane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

17
Patents

156.08987 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.09715 134.3
[M+Na]+ 179.07909 144.4
[M+NH4]+ 174.12369 140.8
[M+K]+ 195.05303 140.2
[M-H]- 155.08259 133.3
[M+Na-2H]- 177.06454 137.3
[M]+ 156.08932 135.0
[M]- 156.09042 135.0
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