CID 492039

6-[(2,3-dimethyloxiran-2-yl)methyl]-1,3-dimethyl-pyrimidine-2,4-dione

Structural Information

Molecular Formula
C11H16N2O3
SMILES
CC1C(O1)(C)CC2=CC(=O)N(C(=O)N2C)C
InChI
InChI=1S/C11H16N2O3/c1-7-11(2,16-7)6-8-5-9(14)13(4)10(15)12(8)3/h5,7H,6H2,1-4H3
InChIKey
FDODINIYMIDPJC-UHFFFAOYSA-N
Compound name
6-[(2,3-dimethyloxiran-2-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

224.11609 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.12337 153.7
[M+Na]+ 247.10531 167.9
[M-H]- 223.10881 160.9
[M+NH4]+ 242.14991 166.5
[M+K]+ 263.07925 165.6
[M+H-H2O]+ 207.11335 146.9
[M+HCOO]- 269.11429 174.8
[M+CH3COO]- 283.12994 194.2
[M+Na-2H]- 245.09076 159.0
[M]+ 224.11554 162.2
[M]- 224.11664 162.2
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

No patent data available for this compound.