CID 452903

1-(2ohetome)-6phot

Structural Information

Molecular Formula
C14H16N2O5
SMILES
CC1=C(N(C(=O)NC1=O)COCCO)OC2=CC=CC=C2
InChI
InChI=1S/C14H16N2O5/c1-10-12(18)15-14(19)16(9-20-8-7-17)13(10)21-11-5-3-2-4-6-11/h2-6,17H,7-9H2,1H3,(H,15,18,19)
InChIKey
GYZFHCDOACNPPN-UHFFFAOYSA-N
Compound name
1-(2-hydroxyethoxymethyl)-5-methyl-6-phenoxypyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

292.10593 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.11321 163.5
[M+Na]+ 315.09515 172.8
[M-H]- 291.09865 165.6
[M+NH4]+ 310.13975 175.1
[M+K]+ 331.06909 168.6
[M+H-H2O]+ 275.10319 154.6
[M+HCOO]- 337.10413 183.4
[M+CH3COO]- 351.11978 196.4
[M+Na-2H]- 313.08060 167.9
[M]+ 292.10538 167.1
[M]- 292.10648 167.1
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.