CID 455487

1-(2-hydroxyethoxymethyl)-5,6,7,8-tetrahydroquinazoline-2,4-dione

Structural Information

Molecular Formula
C11H16N2O4
SMILES
C1CCC2=C(C1)C(=O)NC(=O)N2COCCO
InChI
InChI=1S/C11H16N2O4/c14-5-6-17-7-13-9-4-2-1-3-8(9)10(15)12-11(13)16/h14H,1-7H2,(H,12,15,16)
InChIKey
FJZJBXRIHUPUIL-UHFFFAOYSA-N
Compound name
1-(2-hydroxyethoxymethyl)-5,6,7,8-tetrahydroquinazoline-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.11101 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.11829 151.0
[M+Na]+ 263.10023 159.0
[M-H]- 239.10373 150.0
[M+NH4]+ 258.14483 165.7
[M+K]+ 279.07417 155.2
[M+H-H2O]+ 223.10827 143.6
[M+HCOO]- 285.10921 167.3
[M+CH3COO]- 299.12486 186.3
[M+Na-2H]- 261.08568 156.4
[M]+ 240.11046 150.4
[M]- 240.11156 150.4
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.